[2,4-dibromo-6-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 3-fluorobenzoate

Formula:C26H17N2O3Br2F Mutagenic:none Tumorigenic:high Reproductive Effective:high [2,4-dibromo-6-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 3-fluorobenzoate is not a drug-like molecule.

MolName	[2,4-dibromo-6-[(Z)-[(2-naphthalen-1-ylacetyl)hydrazinylidene]methyl]phenyl] 3-fluorobenzoate
MolecularFormula	C26H17N2O3Br2F
Smiles	O=C(Cc1cccc2ccccc12)N/N=C\c1cc(Br)cc(Br)c1OC(c1cc(F)ccc1)=O
InChI	InChI=1S/C26H17Br2FN2O3/c27-20-11-19(25(23(28)14-20)34-26(33)18-8-4-9-21(29)12-18)15-30-31-24(32)13-17-7-3-6-16-5-1-2-10-22(16)17/h1-12,14-15H,13H2,(H,31,32)
InChIK	ILZIMDCRVPFZNN-UHFFFAOYSA-N
TotalMolweight	584.238
Molweight	584.238
MonoisotopicMass	581.958993
CLogP	7.3758
CLogS	-8.744
H Acceptors	5
H Donors	1
TotalSurfaceArea	366.47
Relative PSA	0.16113
PolarSurfaceArea	67.76
Druglikeness	0.89902
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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