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[2-[(Z)-[[8-[(2Z)-2-[[2-(4-chlorobenzoyl)oxyphenyl]methylidene]hydrazinyl]-8-oxooctanoyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate

Formula:C36H32N4O6Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [2-[(Z)-[[8-[(2Z)-2-[[2-(4-chlorobenzoyl)oxyphenyl]methylidene]hydrazinyl]-8-oxooctanoyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate is not a drug-like molecule.
MolName[2-[(Z)-[[8-[(2Z)-2-[[2-(4-chlorobenzoyl)oxyphenyl]methylidene]hydrazinyl]-8-oxooctanoyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzoate
MolecularFormulaC36H32N4O6Cl2
SmilesO=C(CCCCCCC(N/N=C\c(cccc1)c1OC(c(cc1)ccc1Cl)=O)=O)N/N=C\c(cccc1)c1OC(c(cc1)ccc1Cl)=O
InChIInChI=1S/C36H32Cl2N4O6/c37-29-19-15-25(16-20-29)35(45)47-31-11-7-5-9-27(31)23-39-41-33(43)13-3-1-2-4-14-34(44)42-40-24-28-10-6-8-12-32(28)48-36(46)26-17-21-30(38)22-18-26/h5-12,15-24H,1-4,13-14H2,(H,41,43)(H,42,44)
InChIKCIMQUUNJAWXTMV-UHFFFAOYSA-N
TotalMolweight687.578
Molweight687.578
MonoisotopicMass686.16989
CLogP9.3378
CLogS-10.15
H Acceptors10
H Donors2
TotalSurfaceArea529.38
Relative PSA0.22309
PolarSurfaceArea135.52
Druglikeness-4.3681
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms48
NonCHAtoms12
Electronegative Atoms12
Rotatable Bond17
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms8
Symmetricatoms26
StereoCon

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