COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382421
Chemical Name: (2E)-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(o1)c1cccc(c1)[N+](=O)[O-])/C(=O)Nc1nnc(s1)C(F)(F)F

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Molecular Weight: 435.34
Empirical Formula: C17H8F3N5O4S

Physical State: Dry powder
Available Amount: 58 mg

Lipinsky:
logP: 4.128
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 165
Number of rings: 3

     

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