COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035423
Chemical Name: (4-chloro-3-nitrophenyl)[(1Z)-8-ethoxy-4,4-dimethyl-1-(phenylimino)-1,4-dihydro-5H-[1,2]dithiolo[3,4-c]quinolin-5-yl]methanone
Smiles: CCOc1ccc2c(c1)c1/c(=N/c3ccccc3)/ssc1C(N2C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)(C)C

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Molecular Weight: 552.07
Empirical Formula: C27H22ClN3O4S2

Physical State: Dry powder
Available Amount: 432 mg

Lipinsky:
logP: 8.246
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 138
Number of rings: 5

     

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