COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK444509
Chemical Name: 2-{[(4-methyl-3,5-dinitrophenyl)carbonyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxamide
Smiles: O=C(c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])C)Nc1sc2c(c1C(=O)N)CCCCCC2

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Molecular Weight: 432.46
Empirical Formula: C19H20N4O6S

Physical State: Dry powder
Available Amount: 513 mg

Lipinsky:
logP: 5.725
Rotatable bonds: 1
H-donors: 3
H-acceptors: 6
PSA: 192
Number of rings: 3

     

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