COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK732972
Chemical Name: (2E)-3-[5-(1,3-benzothiazol-2-yl)furan-2-yl]-2-cyano-N-(4-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1nc2c(s1)cccc2)/C(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 416.42
Empirical Formula: C21H12N4O4S

Physical State: Dry powder
Available Amount: 353 mg

Lipinsky:
logP: 5.137
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 152
Number of rings: 4

     

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