COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889064
Chemical Name: (4-chloro-3-nitrophenyl)[(7E)-7-(4-fluorobenzylidene)-3-(4-fluorophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]methanone
Smiles: Fc1ccc(cc1)C1N(N=C2C1CCC/C/2=C\c1ccc(cc1)F)C(=O)c1ccc(c(c1)[N+](=O)[O-])Cl

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Molecular Weight: 507.92
Empirical Formula: C27H20ClF2N3O3

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 5.985
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 78
Number of rings: 5

     

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