COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK429081
Chemical Name: (2E)-1-(1H-benzotriazol-1-yl)-3-[4-(propan-2-yl)phenyl]prop-2-en-1-one
Smiles: CC(c1ccc(cc1)/C=C/C(=O)n1nnc2c1cccc2)C

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Molecular Weight: 291.35
Empirical Formula: C18H17N3O

Physical State: Dry powder
Available Amount: 745 mg

Lipinsky:
logP: 4.951
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 47
Number of rings: 3

     

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