[4-[(Z)-(naphthalene-1-carbonylhydrazinylidene)methyl]phenyl] 2,4-dichlorobenzoate

Formula:C25H16N2O3Cl2 Mutagenic:none Tumorigenic:high Reproductive Effective:none [4-[(Z)-(naphthalene-1-carbonylhydrazinylidene)methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName	[4-[(Z)-(naphthalene-1-carbonylhydrazinylidene)methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormula	C25H16N2O3Cl2
Smiles	O=C(c1cccc2ccccc12)N/N=C\c(cc1)ccc1OC(c(ccc(Cl)c1)c1Cl)=O
InChI	InChI=1S/C25H16Cl2N2O3/c26-18-10-13-22(23(27)14-18)25(31)32-19-11-8-16(9-12-19)15-28-29-24(30)21-7-3-5-17-4-1-2-6-20(17)21/h1-15H,(H,29,30)
InChIK	HSCWYRCERHJOBL-UHFFFAOYSA-N
TotalMolweight	463.319
Molweight	463.319
MonoisotopicMass	462.053797
CLogP	7.0385
CLogS	-8.269
H Acceptors	5
H Donors	1
TotalSurfaceArea	339.94
Relative PSA	0.17371
PolarSurfaceArea	67.76
Druglikeness	4.0416
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.625
Fragments	1
Non HAtoms	32
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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