(2Z,6Z)-2,6-bis(phenylhydrazinylidene)cyclohex-4-ene-1,3-dione

Formula:C18H14N4O2 Mutagenic:none Tumorigenic:high Reproductive Effective:none (2Z,6Z)-2,6-bis(phenylhydrazinylidene)cyclohex-4-ene-1,3-dione is not a drug-like molecule.

MolName(2Z,6Z)-2,6-bis(phenylhydrazinylidene)cyclohex-4-ene-1,3-dione
MolecularFormulaC18H14N4O2
SmilesO=C(C=C/C(/C1=O)=N/Nc2ccccc2)/C1=N/Nc1ccccc1
InChIInChI=1S/C18H14N4O2/c23-16-12-11-15(21-19-13-7-3-1-4-8-13)18(24)17(16)22-20-14-9-5-2-6-10-14/h1-12,19-20H
InChIKNDLIECNOSIXXSC-UHFFFAOYSA-N
TotalMolweight318.335
Molweight318.335
MonoisotopicMass318.111676
CLogP5.439
CLogS-2.948
H Acceptors6
H Donors2
TotalSurfaceArea250.38
Relative PSA0.28764
PolarSurfaceArea82.92
Druglikeness3.1111
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.625
Fragments1
Non HAtoms24
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond4
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Symmetricatoms4
StereoCon

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