[1-[(Z)-[[2-(4-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]naphthalen-2-yl] 4-chlorobenzoate

Formula:C26H17N3O4Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none [1-[(Z)-[[2-(4-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]naphthalen-2-yl] 4-chlorobenzoate is not a drug-like molecule.

MolName	[1-[(Z)-[[2-(4-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]naphthalen-2-yl] 4-chlorobenzoate
MolecularFormula	C26H17N3O4Cl2
Smiles	O=C(C(N/N=C\c(c1ccccc1cc1)c1OC(c(cc1)ccc1Cl)=O)=O)Nc(cc1)ccc1Cl
InChI	InChI=1S/C26H17Cl2N3O4/c27-18-8-5-17(6-9-18)26(34)35-23-14-7-16-3-1-2-4-21(16)22(23)15-29-31-25(33)24(32)30-20-12-10-19(28)11-13-20/h1-15H,(H,30,32)(H,31,33)
InChIK	FECJMYDWUVKIBM-UHFFFAOYSA-N
TotalMolweight	506.344
Molweight	506.344
MonoisotopicMass	505.059611
CLogP	5.9808
CLogS	-8.073
H Acceptors	7
H Donors	2
TotalSurfaceArea	369.15
Relative PSA	0.22633
PolarSurfaceArea	96.86
Druglikeness	3.4163
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.57143
Fragments	1
Non HAtoms	35
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
Symmetricatoms	4
Amides	1
StereoCon

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1 - [1-[(Z)-[[2-(4-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]naphthalen-2-yl] 4-chlorobenzoate | 2 - [1-[(Z)-[[2-(4-chloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]naphthalen-2-yl] 4-chlorobenzoate

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