[1-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate

Formula:C27H19N3O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none [1-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate is not a drug-like molecule.

MolName	[1-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate
MolecularFormula	C27H19N3O4Cl2
Smiles	O=C(CNC(c(cc1)cc(Cl)c1Cl)=O)N/N=C\c(c1ccccc1cc1)c1OC(c1ccccc1)=O
InChI	InChI=1S/C27H19Cl2N3O4/c28-22-12-10-19(14-23(22)29)26(34)30-16-25(33)32-31-15-21-20-9-5-4-6-17(20)11-13-24(21)36-27(35)18-7-2-1-3-8-18/h1-15H,16H2,(H,30,34)(H,32,33)
InChIK	KOACBAAKVUTNLE-UHFFFAOYSA-N
TotalMolweight	520.371
Molweight	520.371
MonoisotopicMass	519.075261
CLogP	6.1222
CLogS	-8.036
H Acceptors	7
H Donors	2
TotalSurfaceArea	382.91
Relative PSA	0.2182
PolarSurfaceArea	96.86
Druglikeness	5.1016
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.55556
Fragments	1
Non HAtoms	36
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	8
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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1 - [1-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate | 2 - [1-[(Z)-[[2-[(3,4-dichlorobenzoyl)amino]acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate

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