MetaADEDB 2.0 @ LMMD
N-(4,4-diphenyl-3-butenyl)nipecotic acid
(TXQKSMSLZVKQBI-UHFFFAOYSA-N)
Structure
SMILES
OC(=O)C1CCCN(C1)CCC=C(c1ccccc1)c1ccccc1
Molecular Formula:
C22H25NO2
Molecular Weight:
335.439
Log P:
4.2429
Hydrogen Bond Acceptor:
3
Hydrogen Bond Donor:
1
TPSA:
40.54
CAS Number(s):
85375-85-5; 95403-36-4
Synonym(s)
1.
N-(4,4-diphenyl-3-butenyl)nipecotic acid
2.
N-(4,4-diphenyl-3-butenyl)homo-beta-proline
3.
N-(4,4-diphenyl-3-butenyl)piperidine-3-carboxylic acid
4.
SK&F 100561
5.
SK&F 89976
6.
SK&F 89976-A
7.
SK&F 89976-A, (+-)-isomer
8.
SK&F 89976-A, (R)-isomer
9.
SK&F 89976-A, hydrochloride
10.
SK&F 89976-A, hydrochloride, (R)-isomer
11.
SK&F 89976-A, hydrochloride, (S)-isomer
12.
SK&F-100561
13.
SKF 89976A
External Link(s)
MeSHC045598
PubChem Compound92409
BindingDB50003634
50047910
ChEBI91734
CHEMBLCHEMBL38686
IUPHAR/BPS Guide to PHARMACOLOGY4705
Therapeutic Target DatabaseD08YGM
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Seizures2474871CTD
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