COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671674
Chemical Name: (5R,6R)-6-(1H-benzotriazol-1-yl)-5-(3-nitrophenyl)-3-phenylcyclohex-2-en-1-one
Smiles: O=C1C=C(C[C@@H]([C@H]1n1nnc2c1cccc2)c1cccc(c1)[N+](=O)[O-])c1ccccc1

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Molecular Weight: 410.43
Empirical Formula: C24H18N4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.996
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 5

     

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