COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK845048
Chemical Name: ethyl3,6-dihydroxy-6-methyl-4-(3-nitrophenyl)-4,5,6,7-tetrahydro-2H-indazole-5-carboxylate
Smiles: CCOC(=O)C1C(c2cccc(c2)[N+](=O)[O-])c2c(O)[nH]nc2CC1(C)O

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Molecular Weight: 361.35
Empirical Formula: C17H19N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.028
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 141
Number of rings: 3

     

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