2-[[(Z)-3-(2-hydroxyphenyl)imino-2-nitroprop-1-enyl]amino]phenol

Formula:C15H13N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[[(Z)-3-(2-hydroxyphenyl)imino-2-nitroprop-1-enyl]amino]phenol is a drug-like molecule.

MolName2-[[(Z)-3-(2-hydroxyphenyl)imino-2-nitroprop-1-enyl]amino]phenol
MolecularFormulaC15H13N3O4
Smiles[O-][N+](/C(/C=N/c(cccc1)c1O)=C\Nc(cccc1)c1O)=O
InChIInChI=1S/C15H13N3O4/c19-14-7-3-1-5-12(14)16-9-11(18(21)22)10-17-13-6-2-4-8-15(13)20/h1-10,16,19-20H
InChIKNZPHMFNIALMFGE-UHFFFAOYSA-N
TotalMolweight299.285
Molweight299.285
MonoisotopicMass299.090607
CLogP0.7592
CLogS-3.162
H Acceptors7
H Donors3
TotalSurfaceArea230.32
Relative PSA0.34556
PolarSurfaceArea110.67
Druglikeness-5.0653
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionsimine/hydrazone of aldehyde
Shape Index0.59091
Fragments1
Non HAtoms22
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
AcidicOxygens1
StereoCon

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