[1-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2,4-dichlorobenzoate

Formula:C26H17N2O4Cl2F Mutagenic:high Tumorigenic:high Reproductive Effective:none [1-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName[1-[(Z)-[[2-(4-fluorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2,4-dichlorobenzoate
MolecularFormulaC26H17N2O4Cl2F
SmilesO=C(COc(cc1)ccc1F)N/N=C\c(c1ccccc1cc1)c1OC(c(ccc(Cl)c1)c1Cl)=O
InChIInChI=1S/C26H17Cl2FN2O4/c27-17-6-11-21(23(28)13-17)26(33)35-24-12-5-16-3-1-2-4-20(16)22(24)14-30-31-25(32)15-34-19-9-7-18(29)8-10-19/h1-14H,15H2,(H,31,32)
InChIKJKGPWPODNZYHGV-UHFFFAOYSA-N
TotalMolweight511.335
Molweight511.335
MonoisotopicMass510.05494
CLogP6.7142
CLogS-8.363
H Acceptors6
H Donors1
TotalSurfaceArea370.05
Relative PSA0.1866
PolarSurfaceArea76.99
Druglikeness2.6806
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantlow
Nasty Functionsacyl-hydrazone; imine/hydrazone of aldehyde
Shape Index0.57143
Fragments1
Non HAtoms35
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond8
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms3
Symmetricatoms2
StereoCon

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