[1-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2-chlorobenzoate

Formula:C32H21N2O5Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:high [1-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2-chlorobenzoate is not a drug-like molecule.

MolName	[1-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2-chlorobenzoate
MolecularFormula	C32H21N2O5Cl3
Smiles	O=C(C(Oc(cc1)ccc1Cl)Oc(cc1)ccc1Cl)N/N=C\c(c1ccccc1cc1)c1OC(c(cccc1)c1Cl)=O
InChI	InChI=1S/C32H21Cl3N2O5/c33-21-10-14-23(15-11-21)40-32(41-24-16-12-22(34)13-17-24)30(38)37-36-19-27-25-6-2-1-5-20(25)9-18-29(27)42-31(39)26-7-3-4-8-28(26)35/h1-19,32H,(H,37,38)
InChIK	MLTBCJZJHQCNPT-UHFFFAOYSA-N
TotalMolweight	619.887
Molweight	619.887
MonoisotopicMass	618.051604
CLogP	8.4571
CLogS	-10.056
H Acceptors	7
H Donors	1
TotalSurfaceArea	447.62
Relative PSA	0.1766
PolarSurfaceArea	86.22
Druglikeness	4.2953
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.45238
Fragments	1
Non HAtoms	42
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	10
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	28
Sp3Atoms	4
Symmetricatoms	10
StereoCon

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1 - [1-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2-chlorobenzoate | 2 - [1-[(Z)-[[2,2-bis(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]naphthalen-2-yl] 2-chlorobenzoate

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