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(NE)-N-[(6E)-2-[(hydroxyamino)-(4-phenylmethoxyphenyl)methyl]-6-[(4-phenylmethoxyphenyl)methylidene]cyclohexylidene]hydroxylamine

Formula:C34H34N2O4 Mutagenic:none Tumorigenic:none Reproductive Effective:high (NE)-N-[(6E)-2-[(hydroxyamino)-(4-phenylmethoxyphenyl)methyl]-6-[(4-phenylmethoxyphenyl)methylidene]cyclohexylidene]hydroxylamine is not a drug-like molecule.
MolName(NE)-N-[(6E)-2-[(hydroxyamino)-(4-phenylmethoxyphenyl)methyl]-6-[(4-phenylmethoxyphenyl)methylidene]cyclohexylidene]hydroxylamine
MolecularFormulaC34H34N2O4
SmilesONC(C(CCC/C1=C\c(cc2)ccc2OCc2ccccc2)/C1=N\O)c(cc1)ccc1OCc1ccccc1
InChIInChI=1S/C34H34N2O4/c37-35-33(28-16-20-31(21-17-28)40-24-27-10-5-2-6-11-27)32-13-7-12-29(34(32)36-38)22-25-14-18-30(19-15-25)39-23-26-8-3-1-4-9-26/h1-6,8-11,14-22,32-33,35,37-38H,7,12-13,23-24H2
InChIKBOAQPWHPPGAOBM-UHFFFAOYSA-N
TotalMolweight534.654
Molweight534.654
MonoisotopicMass534.251858
CLogP6.5351
CLogS-7.275
H Acceptors6
H Donors3
TotalSurfaceArea424.68
Relative PSA0.16288
PolarSurfaceArea83.31
Druglikeness-2.569
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.625
Fragments1
Non HAtoms40
NonCHAtoms6
Electronegative Atoms6
StereoCenters2
Rotatable Bond10
Rings Closures5
Small Rings5
Aromatic Rings4
Aromatic Atoms24
Sp3Atoms12
Symmetricatoms8
StereoConunknown chirality

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