COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK528340
Chemical Name: (2E)-3-[(3-methoxyphenyl)amino]-2-[4-(6-nitro-2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: COc1cccc(c1)N/C=C(/c1scc(n1)c1cc2cc(ccc2oc1=O)[N+](=O)[O-])\C#N

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Molecular Weight: 446.44
Empirical Formula: C22H14N4O5S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 4.538
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 158
Number of rings: 4

     

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