COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK752476
Chemical Name: (5S,6R)-6-(1H-benzotriazol-1-yl)-3-phenyl-5-(thiophen-2-yl)cyclohex-2-en-1-one
Smiles: O=C1C=C(C[C@@H]([C@H]1n1nnc2c1cccc2)c1cccs1)c1ccccc1

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Molecular Weight: 371.46
Empirical Formula: C22H17N3OS

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.944
Rotatable bonds: 0
H-donors: 0
H-acceptors: 1
PSA: 76
Number of rings: 5

     

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