COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444393
Chemical Name: 4-chloro-N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-3-nitrobenzamide
Smiles: N#Cc1c(NC(=O)c2ccc(c(c2)[N+](=O)[O-])Cl)sc2c1CCCCCC2

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Molecular Weight: 389.86
Empirical Formula: C18H16ClN3O3S

Physical State: Dry powder
Available Amount: 823 mg

Lipinsky:
logP: 5.509
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 3

     

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