4-[(E)-C-phenylcarbonohydrazonoyl]benzonitrile

Formula:C14H11N3 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-[(E)-C-phenylcarbonohydrazonoyl]benzonitrile is a drug-like molecule.

MolName	4-[(E)-C-phenylcarbonohydrazonoyl]benzonitrile
MolecularFormula	C14H11N3
Smiles	N/N=C(\c1ccccc1)/c(cc1)ccc1C#N
InChI	InChI=1S/C14H11N3/c15-10-11-6-8-13(9-7-11)14(17-16)12-4-2-1-3-5-12/h1-9H,16H2
InChIK	QMXKWJJHGMVDST-UHFFFAOYSA-N
TotalMolweight	221.262
Molweight	221.262
MonoisotopicMass	221.095297
CLogP	2.5991
CLogS	-4.942
H Acceptors	3
H Donors	1
TotalSurfaceArea	186.22
Relative PSA	0.21663
PolarSurfaceArea	62.17
Druglikeness	-7.0009
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.64706
Fragments	1
Non HAtoms	17
NonCHAtoms	3
Electronegative Atoms	3
Rotatable Bond	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	4
StereoCon

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