COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053042
Chemical Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)(2,2,4,7-tetramethyl-4-phenyl-3,4-dihydroquinolin-1(2H)-yl)methanone
Smiles: Cc1ccc2c(c1)N(C(=O)c1sc3c(c1Cl)ccc(c3)[N+](=O)[O-])C(CC2(C)c1ccccc1)(C)C

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Molecular Weight: 505.04
Empirical Formula: C28H25ClN2O3S

Physical State: Dry powder
Available Amount: 447 mg

Lipinsky:
logP: 8.456
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 94
Number of rings: 5

     

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