[4-[(Z)-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate

Formula:C26H18N2O4BrCl Mutagenic:low Tumorigenic:low Reproductive Effective:none [4-[(Z)-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate is not a drug-like molecule.

MolName[4-[(Z)-[[2-(1-bromonaphthalen-2-yl)oxyacetyl]hydrazinylidene]methyl]phenyl] 2-chlorobenzoate
MolecularFormulaC26H18N2O4BrCl
SmilesO=C(COc(ccc1ccccc11)c1Br)N/N=C\c(cc1)ccc1OC(c(cccc1)c1Cl)=O
InChIInChI=1S/C26H18BrClN2O4/c27-25-20-6-2-1-5-18(20)11-14-23(25)33-16-24(31)30-29-15-17-9-12-19(13-10-17)34-26(32)21-7-3-4-8-22(21)28/h1-15H,16H2,(H,30,31)
InChIKFWTBJZPUWAILCE-UHFFFAOYSA-N
TotalMolweight537.796
Molweight537.796
MonoisotopicMass536.013846
CLogP6.7326
CLogS-8.147
H Acceptors6
H Donors1
TotalSurfaceArea366.91
Relative PSA0.18819
PolarSurfaceArea76.99
Druglikeness2.2306
Mutageniclow
Tumorigeniclow
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.64706
Fragments1
Non HAtoms34
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms3
Symmetricatoms2
StereoCon

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