COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK898201
Chemical Name: (2E)-3-[(5-chloro-2-methylphenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Smiles: N#C/C(=C\Nc1cc(Cl)ccc1C)/c1scc(n1)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 396.86
Empirical Formula: C19H13ClN4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.459
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 122
Number of rings: 3

     

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