COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL010785
Chemical Name: (2E)-1-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)N2CCC(CC2)c2nc3c([nH]2)cccc3)ccc1OC

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Molecular Weight: 391.47
Empirical Formula: C23H25N3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.358
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 67
Number of rings: 4

     

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