COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK847317
Chemical Name: 1-[6-hydroxy-3,6-dimethyl-4-(4-nitrophenyl)-4,5,6,7-tetrahydro-3aH-indazol-5-yl]ethanone
Smiles: CC1=NN=C2C1C(c1ccc(cc1)[N+](=O)[O-])C(C(C2)(C)O)C(=O)C

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Molecular Weight: 329.36
Empirical Formula: C17H19N3O4

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 0.956
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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