MW: 445.52
MDL: MFCD02063152
TNP:
LogP: 2.36
LogS: -3.81
Acceptors: 3
Donors: 0
Rotation Bonds: 3
Chiral Centers: 2
N+O: 8
LIPINSKY: 4
IUPAC: 11-[(3E)-4-(2,3-dimethyl-5-oxo-1-phenyl(3-pyrazolin-4-yl))-2-oxo-4-azabut-3-en yl]-7,11-diazatricyclo[7.3.1.0<2,7>]trideca-2,4-dien-6-one
Smiles: c1(c(n(c2ccccc2)n(c1C)C)=O)/N=C\C(CN1CC2c3cccc(n3CC(C1)C2)=O)=O
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