N'-[(3E)-4-phenylbuta-1,3-dien-2-yl]pyridine-4-carbohydrazide

Formula:C16H15N3O Mutagenic:none Tumorigenic:high Reproductive Effective:high N'-[(3E)-4-phenylbuta-1,3-dien-2-yl]pyridine-4-carbohydrazide is a drug-like molecule.

MolName	N'-[(3E)-4-phenylbuta-1,3-dien-2-yl]pyridine-4-carbohydrazide
MolecularFormula	C16H15N3O
Smiles	C=C(/C=C/c1ccccc1)NNC(c1ccncc1)=O
InChI	InChI=1S/C16H15N3O/c1-13(7-8-14-5-3-2-4-6-14)18-19-16(20)15-9-11-17-12-10-15/h2-12,18H,1H2,(H,19,20)
InChIK	WBLZXMPESDVRBF-UHFFFAOYSA-N
TotalMolweight	265.315
Molweight	265.315
MonoisotopicMass	265.121512
CLogP	2.3244
CLogS	-3.55
H Acceptors	4
H Donors	2
TotalSurfaceArea	221.7
Relative PSA	0.21168
PolarSurfaceArea	54.02
Druglikeness	-0.76025
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.7
Fragments	1
Non HAtoms	20
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	4
Aromatic Nitrogens	1
StereoCon

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