NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
|
methyl 4-[({1-[(3-fluorophenyl)methyl]-5-oxopyrrolidin-3-yl}amino)methyl]benzoate
|
|
|
IUPAC Traditional name
|
methyl 4-[({1-[(3-fluorophenyl)methyl]-5-oxopyrrolidin-3-yl}amino)methyl]benzoate
|
|
|
Synonyms
|
methyl 4-({[1-(3-fluorobenzyl)-5-oxo-3-pyrrolidinyl]amino}methyl)benzoate
|
|
|
DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
H Acceptors
|
3
|
H Donor
|
1
|
LogD (pH = 5.5)
|
-0.053322222
|
LogD (pH = 7.4)
|
1.6564059
|
Log P
|
2.6458943
|
Molar Refractivity
|
96.2611 cm3
|
Polarizability
|
37.059555 Å3
|
Polar Surface Area
|
58.64 Å2
|
Rotatable Bonds
|
7
|
Lipinski's Rule of Five
|
true
|
H Acceptors
|
4
|
H Donor
|
1
|
Log P
|
3.49
|
LOG S
|
-3.31
|
Polar Surface Area
|
58.64 Å2
|
Rotatable Bonds
|
6
|
PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent