COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK195701
Chemical Name: (2E)-3-{5-[(4-chlorophenyl)sulfanyl]thiophen-2-yl}-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C/c1ccc(s1)Sc1ccc(cc1)Cl)/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 398.89
Empirical Formula: C19H11ClN2O2S2

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 7.445
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 123
Number of rings: 3

     

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