[1-[(Z)-[[2-(2-prop-2-enylphenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate

Formula:C29H24N2O4 Mutagenic:high Tumorigenic:high Reproductive Effective:none [1-[(Z)-[[2-(2-prop-2-enylphenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate is not a drug-like molecule.

MolName[1-[(Z)-[[2-(2-prop-2-enylphenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] benzoate
MolecularFormulaC29H24N2O4
SmilesC=CCc(cccc1)c1OCC(N/N=C\c(c1ccccc1cc1)c1OC(c1ccccc1)=O)=O
InChIInChI=1S/C29H24N2O4/c1-2-10-22-12-7-9-16-26(22)34-20-28(32)31-30-19-25-24-15-8-6-11-21(24)17-18-27(25)35-29(33)23-13-4-3-5-14-23/h2-9,11-19H,1,10,20H2,(H,31,32)
InChIKTUOCYUDUEFUNEA-UHFFFAOYSA-N
TotalMolweight464.52
Molweight464.52
MonoisotopicMass464.173608
CLogP6.4298
CLogS-7.289
H Acceptors6
H Donors1
TotalSurfaceArea371.16
Relative PSA0.18604
PolarSurfaceArea76.99
Druglikeness1.2088
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.54286
Fragments1
Non HAtoms35
NonCHAtoms6
Electronegative Atoms6
Rotatable Bond10
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms4
Symmetricatoms2
StereoCon

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