COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK404690
Chemical Name: 6-methyl3-propan-2-yl4-(4-chloro-3-nitrophenyl)-2,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: COC(=O)C1C(C)CC2=C(C1=O)C(c1ccc(c(c1)[N+](=O)[O-])Cl)C(=C(N2)C)C(=O)OC(C)C

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Molecular Weight: 476.91
Empirical Formula: C23H25ClN2O7

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 3.119
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 127
Number of rings: 3

     

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