[1-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2,4-dichlorobenzoate

Formula:C31H21N3O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none [1-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName	[1-[(Z)-[[2-(naphthalene-1-carbonylamino)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2,4-dichlorobenzoate
MolecularFormula	C31H21N3O4Cl2
Smiles	O=C(CNC(c1cccc2ccccc12)=O)N/N=C\c(c1ccccc1cc1)c1OC(c(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C31H21Cl2N3O4/c32-21-13-14-25(27(33)16-21)31(39)40-28-15-12-20-7-2-4-10-23(20)26(28)17-35-36-29(37)18-34-30(38)24-11-5-8-19-6-1-3-9-22(19)24/h1-17H,18H2,(H,34,38)(H,36,37)
InChIK	RAAWIFUJGOIAFB-UHFFFAOYSA-N
TotalMolweight	570.431
Molweight	570.431
MonoisotopicMass	569.090911
CLogP	7.3166
CLogS	-9.642
H Acceptors	7
H Donors	2
TotalSurfaceArea	417.51
Relative PSA	0.20011
PolarSurfaceArea	96.86
Druglikeness	5.1016
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.525
Fragments	1
Non HAtoms	40
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Sp3Atoms	2
Amides	1
StereoCon

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