COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701033
Chemical Name: 1-[6-hydroxy-3,6-dimethyl-4-(3-nitrophenyl)-4,5,6,7-tetrahydro-2H-indazol-5-yl]ethanone
Smiles: CC(=O)C1C(c2cccc(c2)[N+](=O)[O-])c2c(C)[nH]nc2CC1(C)O

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Molecular Weight: 329.36
Empirical Formula: C17H19N3O4

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 1.761
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 111
Number of rings: 3

     

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