NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
(3R,4R)-1-(1,3-benzothiazol-2-yl)-3-cyclopropyl-4-methylpyrrolidin-3-ol
|
|
|
IUPAC Traditional name
|
(3R,4R)-1-(1,3-benzothiazol-2-yl)-3-cyclopropyl-4-methylpyrrolidin-3-ol
|
|
|
Synonyms
|
(3R*,4R*)-1-(1,3-benzothiazol-2-yl)-3-cyclopropyl-4-methylpyrrolidin-3-ol
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
|
13.935367
|
H Acceptors
|
3
|
H Donor
|
1
|
LogD (pH = 5.5)
|
3.347086
|
LogD (pH = 7.4)
|
3.3475292
|
Log P
|
3.3475351
|
Molar Refractivity
|
76.1375 cm3
|
Polarizability
|
30.642143 Å3
|
Polar Surface Area
|
36.36 Å2
|
Rotatable Bonds
|
2
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
2
|
H Donor
|
1
|
Log P
|
2.22
|
LOG S
|
-3.1
|
Polar Surface Area
|
36.36 Å2
|
Rotatable Bonds
|
2
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent