COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK878612
Chemical Name: 4-{2-[(Z)-2-(1,3-benzodioxol-5-ylamino)-1-cyanoethenyl]-1,3-thiazol-4-yl}phenylacetate
Smiles: N#C/C(=C/Nc1ccc2c(c1)OCO2)/c1scc(n1)c1ccc(cc1)OC(=O)C

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Molecular Weight: 405.43
Empirical Formula: C21H15N3O4S

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 3.895
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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