Chembase list of 866358 unique molecular structures

tert-butyl 4-acetyl-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxyl...

$$$$ Data

M. F.

C21H28BNO5

Suppliers	Catalog Number
Bide Pharmatech	BD231493

Database	Data ID
PubChem	70700255

M. W.

385.26172

CAS

1256359-97-3

Similarity

N/A

ID: 291552

7-bromo-1H-1,2,3-benzotriazole

$$$$ Data

M. F.

C6H4BrN3

Suppliers	Catalog Number
Bide Pharmatech	BD231496

Database	Data ID
PubChem	21707869

M. W.

198.02006

CAS

1064721-11-4

Similarity

N/A

ID: 291553

5-bromo-1-butyl-1H-indazole

$$$$ Data

M. F.

C11H13BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231497

Database	Data ID
PubChem	53217445

M. W.

253.13832

CAS

1280786-85-7

Similarity

N/A

ID: 291554

5-bromo-2-butyl-2H-indazole

$$$$ Data

M. F.

C11H13BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231498

Database	Data ID
PubChem	53217446

M. W.

253.13832

CAS

1280786-75-5

Similarity

N/A

ID: 291555

5-bromo-3-butyl-1H-indazole

$$$$ Data

M. F.

C11H13BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231499

Database	Data ID
PubChem	54759036

M. W.

253.13832

CAS

1314988-13-0

Similarity

N/A

ID: 291556

6-bromo-3-butyl-1H-indazole

$$$$ Data

M. F.

C11H13BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231500

Database	Data ID
PubChem	54759033

M. W.

253.13832

CAS

1314987-32-0

Similarity

N/A

ID: 291557

5-bromo-3-cyclopropyl-1H-indazole

$$$$ Data

M. F.

C10H9BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231502

Database	Data ID
PubChem	45480301

M. W.

237.09586

CAS

911305-80-1

Similarity

N/A

ID: 291558

5-bromo-3-cyclopropyl-1-methyl-1H-indazole

$$$$ Data

M. F.

C11H11BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231503

Database	Data ID
PubChem	54759034

M. W.

251.12244

CAS

1311197-79-1

Similarity

N/A

ID: 291559

6-bromo-3-cyclopropyl-1-methyl-1H-indazole

$$$$ Data

M. F.

C11H11BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231504

Database	Data ID
PubChem	54759031

M. W.

251.12244

CAS

1311197-86-0

Similarity

N/A

ID: 291560

5-bromo-2-ethyl-2H-indazole

$$$$ Data

M. F.

C9H9BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231505

Database	Data ID
PubChem	22558977

M. W.

225.08516

CAS

590417-97-3

Similarity

N/A

ID: 291561

5-bromo-6-fluoro-2,1,3-benzothiadiazole

$$$$ Data

M. F.

C6H2BrFN2S

Suppliers	Catalog Number
Bide Pharmatech	BD231506

Database	Data ID
PubChem	53216850

M. W.

233.0608832

CAS

1242336-51-1

Similarity

N/A

ID: 291562

5-(5-bromo-1H-indol-1-yl)pentanoic acid

$$$$ Data

M. F.

C13H14BrNO2

Suppliers	Catalog Number
Bide Pharmatech	BD231507

Database	Data ID
PubChem	43152065

M. W.

296.15976

CAS

1065074-70-5

Similarity

N/A

ID: 291563

5-bromo-1-(propan-2-yl)-1H-indazole

$$$$ Data

M. F.

C10H11BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231508

Database	Data ID
PubChem	53216940

M. W.

239.11174

CAS

1280786-83-5

Similarity

N/A

ID: 291564

5-bromo-1-propyl-1H-indazole

$$$$ Data

M. F.

C10H11BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231510

Database	Data ID
PubChem	53217447

M. W.

239.11174

CAS

1280786-76-6

Similarity

N/A

ID: 291565

5-bromo-2-propyl-2H-indazole

$$$$ Data

M. F.

C10H11BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231511

Database	Data ID
PubChem	53217448

M. W.

239.11174

CAS

1280786-77-7

Similarity

N/A

ID: 291566

5-bromo-3-propyl-1H-indazole

$$$$ Data

M. F.

C10H11BrN2

Suppliers	Catalog Number
Bide Pharmatech	BD231512

Database	Data ID
PubChem	54759035

M. W.

239.11174

CAS

1197943-62-6

Similarity

N/A

ID: 291567

5-bromo-2-tert-butyl-3-hydroxy-2,3-dihydro-1H-isoindol-1-one

$$$$ Data

M. F.

C12H14BrNO2

Suppliers	Catalog Number
Bide Pharmatech	BD231513

Database	Data ID
PubChem	53216926

M. W.

284.14906

CAS

1245563-22-7

Similarity

N/A

ID: 291568

2-tert-butyl-3-hydroxy-4-(trifluoromethyl)-2,3-dihydro-1H-isoindol-1-one

$$$$ Data

M. F.

C13H14F3NO2

Suppliers	Catalog Number
Bide Pharmatech	BD231514

Database	Data ID
PubChem	53217030

M. W.

273.2509696

CAS

1242336-58-8

Similarity

N/A

ID: 291569

2-tert-butyl-3-hydroxy-5-(trifluoromethyl)-2,3-dihydro-1H-isoindol-1-one

$$$$ Data

M. F.

C13H14F3NO2

Suppliers	Catalog Number
Bide Pharmatech	BD231515

Database	Data ID
PubChem	53217029

M. W.

273.2509696

CAS

1242336-73-7

Similarity

N/A

ID: 291570

2-tert-butyl-3-hydroxy-6-(trifluoromethyl)-2,3-dihydro-1H-isoindol-1-one

$$$$ Data

M. F.

C13H14F3NO2

Suppliers	Catalog Number
Bide Pharmatech	BD231516

Database	Data ID
PubChem	53217031

M. W.

273.2509696

CAS

1242336-60-2

Similarity

N/A

ID: 291571

5-[5-(dihydroxyboranyl)-1H-indol-1-yl]pentanoic acid

$$$$ Data

M. F.

C13H16BNO4

Suppliers	Catalog Number
Bide Pharmatech	BD231517

Database	Data ID
PubChem	46738959

M. W.

261.08144

CAS

1072946-60-1

Similarity

N/A

ID: 291572

{2-[(4-fluorophenyl)methoxy]-5-methylphenyl}boronic acid

$$$$ Data

M. F.

C14H14BFO3

Suppliers	Catalog Number
Bide Pharmatech	BD231522

Database	Data ID
PubChem	43327912

M. W.

260.0685632

CAS

1256358-49-2

Similarity

N/A

ID: 291573

2-(4-fluorophenyl)-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

$$$$ Data

M. F.

C17H19BFNO2

Suppliers	Catalog Number
Alfa Aesar	H27168
Bide Pharmatech	BD231523

Database	Data ID
PubChem	44755190

M. W.

299.1476632

CAS

1073354-81-0

Similarity

N/A

ID: 291574

1-(3-fluorophenyl)-3-[3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]urea

$$$$ Data

M. F.

C19H22BFN2O3

Suppliers	Catalog Number
Bide Pharmatech	BD231524

Database	Data ID
PubChem	54759102

M. W.

356.1989832

CAS

874302-03-1

Similarity

N/A

ID: 291575

(2-fluoro-3-propoxyphenyl)boronic acid

$$$$ Data

M. F.

C9H12BFO3

Suppliers	Catalog Number
Bide Pharmatech	BD231527

Database	Data ID
PubChem	54758894

M. W.

197.9991832

CAS

871126-09-9

Similarity

N/A

ID: 291576

1-{[2-fluoro-3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidine

$$$$ Data

M. F.

C17H25BFNO2

Suppliers	Catalog Number
Bide Pharmatech	BD231531

Database	Data ID
PubChem	53217262

M. W.

305.1953032

CAS

1256360-38-9

Similarity

N/A

ID: 291577

1-{[4-fluoro-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methyl}pyrrolidine

$$$$ Data

M. F.

C17H25BFNO2

Suppliers	Catalog Number
Bide Pharmatech	BD231532

Database	Data ID
PubChem	53216800

M. W.

305.1953032

CAS

1256359-05-3

Similarity

N/A

ID: 291578

[3-fluoro-5-(pyrrolidin-1-yl)phenyl]boronic acid

$$$$ Data

M. F.

C10H13BFNO2

Suppliers	Catalog Number
Bide Pharmatech	BD231533

Database	Data ID
PubChem	46739628

M. W.

209.0251232

CAS

1217500-96-3

Similarity

N/A

ID: 291579

{4-[(4-methylpiperazin-1-yl)carbamoyl]phenyl}boronic acid hydrochloride

$$$$ Data

M. F.

C12H19BClN3O3

Suppliers	Catalog Number
Bide Pharmatech	BD231639

Database	Data ID
PubChem	56844274

M. W.

299.56156

CAS

913835-43-5

Similarity

N/A

ID: 291580

N-[(2S,4S)-2-methyl-1,1-dioxo-6-sulfamoyl-2H,3H,4H-1λ⁶,7-thieno[2,3-...

$$$$ Data

M. F.

C10H14N2O5S3

Suppliers	Catalog Number
Bide Pharmatech	BD231641

Database	Data ID
PubChem	10449801

M. W.

338.42356

CAS

147200-03-1

Similarity

N/A

ID: 291581

ethyl 5-formyl-1H-imidazole-4-carboxylate

$$$$ Data

M. F.

C7H8N2O3

Suppliers	Catalog Number
Bide Pharmatech	BD231656

Database	Data ID
PubChem	15008996

M. W.

168.15002

CAS

137159-36-5

Similarity

N/A

ID: 291582

2-(2-chlorophenyl)-2-methylpropanal

$$$$ Data

M. F.

C10H11ClO

Suppliers	Catalog Number
Bide Pharmatech	BD231658

Database	Data ID
PubChem	12022195

M. W.

182.64674

CAS

484001-11-8

Similarity

N/A

ID: 291583

methyl 4-{[(tert-butoxy)carbonyl]amino}but-2-ynoate

$$$$ Data

M. F.

C10H15NO4

Suppliers	Catalog Number
Bide Pharmatech	BD231659

Database	Data ID
PubChem	11745954

M. W.

213.2304

CAS

163852-55-9

Similarity

N/A

ID: 291584

2-hydroxy-2,4-dimethylpentanoic acid

$$$$ Data

M. F.

C7H14O3

Suppliers	Catalog Number
Bide Pharmatech	BD231660

Database	Data ID
PubChem	20196029

M. W.

146.18426

CAS

3639-23-4

Similarity

N/A

ID: 291585

(2S)-N-methyl-2-[(4-methylbenzenesulfonyl)oxy]-2-phenylacetamide

$$$$ Data

M. F.

C16H17NO4S

Suppliers	Catalog Number
Bide Pharmatech	BD231642

Database	Data ID
PubChem	57354974

M. W.

319.37548

CAS

871224-68-9

Similarity

N/A

ID: 291586

(1S)-6,7-dimethoxy-1-{2-[4-(trifluoromethyl)phenyl]ethyl}-1,2,3,4-tetrahydroisoq...

$$$$ Data

M. F.

C20H22F3NO2

Suppliers	Catalog Number
Bide Pharmatech	BD231644

Database	Data ID
PubChem	44133419

M. W.

365.3893896

CAS

769172-81-8

Similarity

N/A

ID: 291587

4-(2-butyl-5-nitro-1-benzofuran-3-carbonyl)phenol

$$$$ Data

M. F.

C19H17NO5

Suppliers	Catalog Number
Bide Pharmatech	BD231646

Database	Data ID
PubChem	11473234

M. W.

339.34198

CAS

141645-16-1

Similarity

N/A

ID: 291588

2-butyl-3-(4-methoxybenzoyl)-5-nitro-1-benzofuran

$$$$ Data

M. F.

C20H19NO5

Suppliers	Catalog Number
Bide Pharmatech	BD231647

Database	Data ID
PubChem	22595055

M. W.

353.36856

CAS

141627-42-1

Similarity

N/A

ID: 291589

methyl 2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylate

$$$$ Data

M. F.

C17H18N2O3S

Suppliers	Catalog Number
Bide Pharmatech	BD231650

Database	Data ID
PubChem	67479596

M. W.

330.40142

CAS

923942-34-1

Similarity

N/A

ID: 291590

2-(4-aminopyridin-3-yl)acetic acid

$$$$ Data

M. F.

C7H8N2O2

Suppliers	Catalog Number
Bide Pharmatech	BD231652

Database	Data ID
PubChem	64125792

M. W.

152.15062

CAS

1227570-90-2

Similarity

N/A

ID: 291591

1-(thiophen-2-yl)cyclopropane-1-carboxylic acid

$$$$ Data

M. F.

C8H8O2S

Suppliers	Catalog Number
Bide Pharmatech	BD231653

Database	Data ID
PubChem	18975706

M. W.

168.21292

CAS

162959-94-6

Similarity

N/A

ID: 291592

1-bromo-7-chloroisoquinoline

$$$$ Data

M. F.

C9H5BrClN

Suppliers	Catalog Number
Bide Pharmatech	BD231654
A&J Pharmtech	AJA-O36533

Database	Data ID
PubChem	70680391

M. W.

242.4997

CAS

1196155-73-3

Similarity

N/A

ID: 291593

3-hydroxy-2-methyl-1,4-dihydroquinolin-4-one

$$$$ Data

M. F.

C10H9NO2

Suppliers	Catalog Number
Bide Pharmatech	BD231655

Database	Data ID
PubChem	440982

M. W.

175.18396

CAS

34497-54-6

Similarity

N/A

ID: 291594

[4-fluoro-3-(oxan-2-yloxy)phenyl]boronic acid

$$$$ Data

M. F.

C11H14BFO4

Suppliers	Catalog Number
Bide Pharmatech	BD231535

Database	Data ID
PubChem	53216325

M. W.

240.0358632

CAS

1217501-17-1

Similarity

N/A

ID: 291595

3-fluoro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenol

$$$$ Data

M. F.

C12H16BFO3

Suppliers	Catalog Number
Alfa Aesar	H59212
Bide Pharmatech	BD231537

Database	Data ID
PubChem	54759098

M. W.

238.0630432

CAS

1029439-02-8

Similarity

N/A

ID: 291596

2-[2-fluoro-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetonitrile

$$$$ Data

M. F.

C14H17BFNO2

Suppliers	Catalog Number
Bide Pharmatech	BD231538

Database	Data ID
PubChem	54759097

M. W.

261.0996832

CAS

1220219-61-3

Similarity

N/A

ID: 291597

[2-fluoro-6-(trifluoromethyl)pyridin-3-yl]boronic acid

$$$$ Data

M. F.

C6H4BF4NO2

Suppliers	Catalog Number
Bide Pharmatech	BD231543

Database	Data ID
PubChem	46739473

M. W.

208.9060728

CAS

1150114-63-8

Similarity

N/A

ID: 291598

(5-formyl-3-methylthiophen-2-yl)boronic acid

$$$$ Data

M. F.

C6H7BO3S

Suppliers	Catalog Number
Bide Pharmatech	BD231548
A&J Pharmtech	AJA-O31524

Database	Data ID
PubChem	46739012

M. W.

169.99398

CAS

1072952-28-3

Similarity

N/A

ID: 291599

4-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]piperazine-1-carbaldehyde

$$$$ Data

M. F.

C17H25BN2O3

Suppliers	Catalog Number
Bide Pharmatech	BD231549

Database	Data ID
PubChem	46739522

M. W.

316.203

CAS

1150561-69-5

Similarity

N/A

ID: 291600

[5-(tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-yl]boronic acid

$$$$ Data

M. F.

C10H16B2O5

Suppliers	Catalog Number
Bide Pharmatech	BD231551

Database	Data ID
PubChem	70700254

M. W.

237.85304

CAS

476004-83-8

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified