COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK723157
Chemical Name: (2E)-3-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-4-methoxyphenyl}-1-(1-hydroxynaphthalen-2-yl)prop-2-en-1-one
Smiles: COc1ccc(cc1CSc1nc2c([nH]1)cccc2)/C=C/C(=O)c1ccc2c(c1O)cccc2

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Molecular Weight: 466.56
Empirical Formula: C28H22N2O3S

Physical State: Dry powder
Available Amount: 355 mg

Lipinsky:
logP: 7.21
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 100
Number of rings: 5

     

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