[2,4-dibromo-6-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 2-iodobenzoate

Formula:C26H17N2O3Br2I Mutagenic:none Tumorigenic:high Reproductive Effective:high [2,4-dibromo-6-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 2-iodobenzoate is not a drug-like molecule.

MolName	[2,4-dibromo-6-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 2-iodobenzoate
MolecularFormula	C26H17N2O3Br2I
Smiles	O=C(Cc1cccc2ccccc12)N/N=C\c1cc(Br)cc(Br)c1OC(c(cccc1)c1I)=O
InChI	InChI=1S/C26H17Br2IN2O3/c27-19-12-18(25(22(28)14-19)34-26(33)21-10-3-4-11-23(21)29)15-30-31-24(32)13-17-8-5-7-16-6-1-2-9-20(16)17/h1-12,14-15H,13H2,(H,31,32)
InChIK	UTJATJOBNSTSFZ-UHFFFAOYSA-N
TotalMolweight	692.14
Molweight	692.14
MonoisotopicMass	689.865063
CLogP	7.7121
CLogS	-9.446
H Acceptors	5
H Donors	1
TotalSurfaceArea	386.4
Relative PSA	0.15282
PolarSurfaceArea	67.76
Druglikeness	2.6901
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.52941
Fragments	1
Non HAtoms	34
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	7
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	2
StereoCon

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