U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ACHIRAL
Molecular Formula C21H25N
Molecular Weight 291.4299
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of L-687384

SMILES

C(N1CCC2(CCCC3=CC=CC=C23)CC1)C4=CC=CC=C4

InChI

InChIKey=MLDCBJPLHBPJET-UHFFFAOYSA-N
InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2

HIDE SMILES / InChI

Molecular Formula C21H25N
Molecular Weight 291.4299
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Targets

Primary TargetPharmacologyConditionPotency
49.0 µM [IC50]
Substance Class Chemical
Record UNII
NVE9K68QA3
Record Status Validated (UNII)
Record Version