COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK105238
Chemical Name: (2E)-2-cyano-3-(4,5-dimethoxy-2-nitrophenyl)-N-(thiophen-2-ylmethyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(OC)c(cc1[N+](=O)[O-])OC)/C(=O)NCc1cccs1

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Molecular Weight: 373.39
Empirical Formula: C17H15N3O5S

Physical State: Dry powder
Available Amount: 337 mg

Lipinsky:
logP: 2.623
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 145
Number of rings: 2

     

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