COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL017078
Chemical Name: (2E)-2-cyano-N-[5-(3,4-dichlorobenzyl)-1,3-thiazol-2-yl]-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OC)O)/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)Cl

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Molecular Weight: 460.34
Empirical Formula: C21H15Cl2N3O3S

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.858
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 123
Number of rings: 3

     

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