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(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-N-[3-[[(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-4-hydroxy-2-oxobut-3-enoyl]amino]propyl]-4-hydroxy-2-oxobut-3-enamide

Formula:C37H32N2O6F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-N-[3-[[(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-4-hydroxy-2-oxobut-3-enoyl]amino]propyl]-4-hydroxy-2-oxobut-3-enamide is not a drug-like molecule.
MolName(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-N-[3-[[(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-4-hydroxy-2-oxobut-3-enoyl]amino]propyl]-4-hydroxy-2-oxobut-3-enamide
MolecularFormulaC37H32N2O6F2
SmilesO/C(/c1cc(Cc(cccc2)c2F)ccc1)=C\C(C(NCCCNC(C(/C=C(/c1cccc(Cc(cccc2)c2F)c1)\O)=O)=O)=O)=O
InChIInChI=1S/C37H32F2N2O6/c38-30-14-3-1-10-26(30)18-24-8-5-12-28(20-24)32(42)22-34(44)36(46)40-16-7-17-41-37(47)35(45)23-33(43)29-13-6-9-25(21-29)19-27-11-2-4-15-31(27)39/h1-6,8-15,20-23,42-43H,7,16-19H2,(H,40,46)(H,41,47)
InChIKQJGDYWCJUQDKJR-UHFFFAOYSA-N
TotalMolweight638.665
Molweight638.665
MonoisotopicMass638.222844
CLogP4.371
CLogS-6.828
H Acceptors8
H Donors4
TotalSurfaceArea490.08
Relative PSA0.20666
PolarSurfaceArea132.8
Druglikeness-1.0251
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.61702
Fragments1
Non HAtoms47
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond14
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms7
Symmetricatoms23
Amides2
StereoCon

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