[4-bromo-2-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 4-chlorobenzoate

Formula:C26H18N2O3BrCl Mutagenic:high Tumorigenic:high Reproductive Effective:none [4-bromo-2-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 4-chlorobenzoate is not a drug-like molecule.

MolName	[4-bromo-2-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 4-chlorobenzoate
MolecularFormula	C26H18N2O3BrCl
Smiles	O=C(Cc1cccc2ccccc12)N/N=C\c(cc(cc1)Br)c1OC(c(cc1)ccc1Cl)=O
InChI	InChI=1S/C26H18BrClN2O3/c27-21-10-13-24(33-26(32)18-8-11-22(28)12-9-18)20(14-21)16-29-30-25(31)15-19-6-3-5-17-4-1-2-7-23(17)19/h1-14,16H,15H2,(H,30,31)
InChIK	FKVCDCPKXYBUPM-UHFFFAOYSA-N
TotalMolweight	521.797
Molweight	521.797
MonoisotopicMass	520.018931
CLogP	7.1558
CLogS	-8.332
H Acceptors	5
H Donors	1
TotalSurfaceArea	356.91
Relative PSA	0.16545
PolarSurfaceArea	67.76
Druglikeness	2.2898
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.57576
Fragments	1
Non HAtoms	33
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
Symmetricatoms	2
StereoCon

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