COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL120078
Chemical Name: 4-{[(2E)-3-(5-bromo-1-benzofuran-2-yl)prop-2-enoyl]amino}phenylthiocyanate
Smiles: N#CSc1ccc(cc1)NC(=O)/C=C/c1cc2c(o1)ccc(c2)Br

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Molecular Weight: 399.27
Empirical Formula: C18H11BrN2O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.178
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 91
Number of rings: 3

     

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