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Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H38FN3O2
Molecular Weight	491.64
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)[C@H]1C2=C(CC[C@@]1(CCN(C)CCCC3=NC4=CC=CC=C4N3)OC(=O)C5CC5)C=C(F)C=C2

InChI

InChIKey=VHHVPDKNKPNKHY-JDXGNMNLSA-N

InChI=1S/C30H38FN3O2/c1-20(2)28-24-13-12-23(31)19-22(24)14-15-30(28,36-29(35)21-10-11-21)16-18-34(3)17-6-9-27-32-25-7-4-5-8-26(25)33-27/h4-5,7-8,12-13,19-21,28H,6,9-11,14-18H2,1-3H3,(H,32,33)/t28-,30-/m0/s1

HIDE SMILES / InChI

Approval Year

Targets

Primary Target	Pharmacology	Potency
Voltage-gated T-type calcium channel alpha-1G subunit 8 Target ID: CHEMBL4641 Sources: https://www.ncbi.nlm.nih.gov/pubmed/14718587	Blocker 537	6.8 µM [IC50]
Voltage-gated T-type calcium channel alpha-1G subunit 8 Target ID: CHEMBL4641 Sources: https://www.ncbi.nlm.nih.gov/pubmed/25255145 \| https://www.ncbi.nlm.nih.gov/pubmed/14718587	Blocker 537	6.8 µM [IC50]
Cation channel sperm-associated protein 1 2 Target ID: CHEMBL1628462 Sources: https://www.ncbi.nlm.nih.gov/pubmed/21412339	Blocker 537	5.7 null [pIC50]
Cation channel sperm-associated protein 2 2 Target ID: Q96P56 Gene ID: 117155.0 Gene Symbol: CATSPER2 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/21412339	Blocker 537	5.7 null [pIC50]

Name

Type

Language

NNC-55-0396 FREE BASE

Common Name

English

CYCLOPROPANECARBOXYLIC ACID, (1S,2S)-2-(2-((3-(1H-BENZIMIDAZOL-2-YL)PROPYL)METHYLAMINO)ETHYL)-6-FLUORO-1,2,3,4-TETRAHYDRO-1-(1-METHYLETHYL)-2-NAPHTHALENYL ESTER

Systematic Name

English

Code System Code Type Description

CAS

357400-14-7

Created by admin on Sat Dec 16 09:30:09 GMT 2023 , Edited by admin on Sat Dec 16 09:30:09 GMT 2023

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FDA UNII

MET7ZRB8Y7

Created by admin on Sat Dec 16 09:30:09 GMT 2023 , Edited by admin on Sat Dec 16 09:30:09 GMT 2023

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EPA CompTox

DTXSID001018002

Created by admin on Sat Dec 16 09:30:09 GMT 2023 , Edited by admin on Sat Dec 16 09:30:09 GMT 2023

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PUBCHEM

9957280

Created by admin on Sat Dec 16 09:30:09 GMT 2023 , Edited by admin on Sat Dec 16 09:30:09 GMT 2023

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ACTIVE MOIETY


					MET7ZRB8Y7

NNC-55-0396 FREE BASE