2-amino-N'-[(Z)-4-hydroxy-2-oxo-4-phenylbut-3-enoyl]benzohydrazide

Formula:C17H15N3O4 Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-amino-N'-[(Z)-4-hydroxy-2-oxo-4-phenylbut-3-enoyl]benzohydrazide is a drug-like molecule.

MolName2-amino-N'-[(Z)-4-hydroxy-2-oxo-4-phenylbut-3-enoyl]benzohydrazide
MolecularFormulaC17H15N3O4
SmilesNc(cccc1)c1C(NNC(C(/C=C(/c1ccccc1)\O)=O)=O)=O
InChIInChI=1S/C17H15N3O4/c18-13-9-5-4-8-12(13)16(23)19-20-17(24)15(22)10-14(21)11-6-2-1-3-7-11/h1-10,21H,18H2,(H,19,23)(H,20,24)
InChIKWMHVHIUIWIFMNI-UHFFFAOYSA-N
TotalMolweight325.323
Molweight325.323
MonoisotopicMass325.106257
CLogP-0.0342
CLogS-3.211
H Acceptors7
H Donors4
TotalSurfaceArea248.77
Relative PSA0.36343
PolarSurfaceArea121.52
Druglikeness-0.1504
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.625
Fragments1
Non HAtoms24
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms1
Symmetricatoms2
Amines1
Aromatic Amines1
StereoCon

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