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(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-1-[4-[(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-4-hydroxy-2-oxobut-3-enoyl]piperazin-1-yl]-4-hydroxybut-3-ene-1,2-dione

Formula:C38H32N2O6F2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-1-[4-[(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-4-hydroxy-2-oxobut-3-enoyl]piperazin-1-yl]-4-hydroxybut-3-ene-1,2-dione is not a drug-like molecule.
MolName(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-1-[4-[(Z)-4-[3-[(2-fluorophenyl)methyl]phenyl]-4-hydroxy-2-oxobut-3-enoyl]piperazin-1-yl]-4-hydroxybut-3-ene-1,2-dione
MolecularFormulaC38H32N2O6F2
SmilesO/C(/c1cc(Cc(cccc2)c2F)ccc1)=C\C(C(N(CC1)CCN1C(C(/C=C(/c1cccc(Cc(cccc2)c2F)c1)\O)=O)=O)=O)=O
InChIInChI=1S/C38H32F2N2O6/c39-31-13-3-1-9-27(31)19-25-7-5-11-29(21-25)33(43)23-35(45)37(47)41-15-17-42(18-16-41)38(48)36(46)24-34(44)30-12-6-8-26(22-30)20-28-10-2-4-14-32(28)40/h1-14,21-24,43-44H,15-20H2
InChIKDPSZPCPLWRZVLD-UHFFFAOYSA-N
TotalMolweight650.676
Molweight650.676
MonoisotopicMass650.222844
CLogP4.8282
CLogS-5.98
H Acceptors8
H Donors2
TotalSurfaceArea488.02
Relative PSA0.17512
PolarSurfaceArea115.22
Druglikeness2.7403
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.58333
Fragments1
Non HAtoms48
NonCHAtoms10
Electronegative Atoms10
Rotatable Bond10
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms8
Symmetricatoms25
Amides2
StereoCon

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