4-chloro-N'-[(E)-3-naphthalen-1-ylprop-2-enoyl]-3-nitrobenzohydrazide

Formula:C20H14N3O4Cl Mutagenic:none Tumorigenic:high Reproductive Effective:none 4-chloro-N'-[(E)-3-naphthalen-1-ylprop-2-enoyl]-3-nitrobenzohydrazide is a drug-like molecule.

MolName	4-chloro-N'-[(E)-3-naphthalen-1-ylprop-2-enoyl]-3-nitrobenzohydrazide
MolecularFormula	C20H14N3O4Cl
Smiles	[O-][N+](c(cc(cc1)C(NNC(/C=C/c2cccc3ccccc23)=O)=O)c1Cl)=O
InChI	InChI=1S/C20H14ClN3O4/c21-17-10-8-15(12-18(17)24(27)28)20(26)23-22-19(25)11-9-14-6-3-5-13-4-1-2-7-16(13)14/h1-12H,(H,22,25)(H,23,26)
InChIK	GUEXFBZZRSPFCP-UHFFFAOYSA-N
TotalMolweight	395.801
Molweight	395.801
MonoisotopicMass	395.067284
CLogP	2.8256
CLogS	-6.482
H Acceptors	7
H Donors	2
TotalSurfaceArea	291.63
Relative PSA	0.27233
PolarSurfaceArea	104.02
Druglikeness	-4.4702
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	aromatic nitro
Shape Index	0.57143
Fragments	1
Non HAtoms	28
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	16
Sp3Atoms	1
AcidicOxygens	1
StereoCon

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