COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK454175
Chemical Name: 2-chloro-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-4-nitrobenzamide
Smiles: N#Cc1c(NC(=O)c2ccc(cc2Cl)[N+](=O)[O-])sc2c1CCCCC2

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Molecular Weight: 375.84
Empirical Formula: C17H14ClN3O3S

Physical State: Dry powder
Available Amount: 3862 mg

Lipinsky:
logP: 5.122
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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