COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528929
Chemical Name: (2E)-3-[(3,4-dichlorophenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1ccc(c(c1)Cl)Cl)/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-]

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Molecular Weight: 485.31
Empirical Formula: C21H10Cl2N4O4S

Physical State: Dry powder
Available Amount: 387 mg

Lipinsky:
logP: 6.173
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 149
Number of rings: 4

     

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