COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK062350
Chemical Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)[2-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl]methanone
Smiles: CC1CC(Nc2ccccc2)c2c(N1C(=O)c1sc3c(c1Cl)ccc(c3)[N+](=O)[O-])cccc2

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Molecular Weight: 477.97
Empirical Formula: C25H20ClN3O3S

Physical State: Dry powder
Available Amount: 423 mg

Lipinsky:
logP: 6.194
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 106
Number of rings: 5

     

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