(E)-3-(4-nitrophenyl)-N'-quinazolin-4-ylprop-2-enehydrazide

Formula:C17H13N5O3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-3-(4-nitrophenyl)-N'-quinazolin-4-ylprop-2-enehydrazide is a drug-like molecule.

MolName	(E)-3-(4-nitrophenyl)-N'-quinazolin-4-ylprop-2-enehydrazide
MolecularFormula	C17H13N5O3
Smiles	[O-][N+](c1ccc(/C=C/C(NNc2ncnc3ccccc23)=O)cc1)=O
InChI	InChI=1S/C17H13N5O3/c23-16(10-7-12-5-8-13(9-6-12)22(24)25)20-21-17-14-3-1-2-4-15(14)18-11-19-17/h1-11H,(H,20,23)(H,18,19,21)
InChIK	SRWZPRPNGKVWGS-UHFFFAOYSA-N
TotalMolweight	335.322
Molweight	335.322
MonoisotopicMass	335.10184
CLogP	2.7696
CLogS	-4.59
H Acceptors	8
H Donors	2
TotalSurfaceArea	255.98
Relative PSA	0.34503
PolarSurfaceArea	112.73
Druglikeness	-4.5345
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.64
Fragments	1
Non HAtoms	25
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
Symmetricatoms	2
Aromatic Nitrogens	2
AcidicOxygens	1
StereoCon

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