COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373549
Chemical Name: cyclopentyl4-(4,5-dimethoxy-2-nitrophenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Smiles: COc1cc([N+](=O)[O-])c(cc1OC)C1C(=C(C)NC2=C1C(=O)CC(C2)(C)C)C(=O)OC1CCCC1

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Molecular Weight: 484.55
Empirical Formula: C26H32N2O7

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 4.109
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 119
Number of rings: 4

     

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