COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK833629
Chemical Name: (2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-[(4-chloro-2,5-dimethoxyphenyl)amino]prop-2-enenitrile
Smiles: N#C/C(=C/Nc1cc(OC)c(cc1OC)Cl)/c1scc(n1)c1ccc2c(c1)OCO2

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Molecular Weight: 441.89
Empirical Formula: C21H16ClN3O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.593
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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