[2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzenesulfonate

Formula:C21H16N2O5Cl2S Mutagenic:none Tumorigenic:none Reproductive Effective:high [2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzenesulfonate is a drug-like molecule.

MolName	[2-[(Z)-[[2-(4-chlorophenoxy)acetyl]hydrazinylidene]methyl]phenyl] 4-chlorobenzenesulfonate
MolecularFormula	C21H16N2O5Cl2S
Smiles	O=C(COc(cc1)ccc1Cl)N/N=C\c(cccc1)c1OS(c(cc1)ccc1Cl)(=O)=O
InChI	InChI=1S/C21H16Cl2N2O5S/c22-16-5-9-18(10-6-16)29-14-21(26)25-24-13-15-3-1-2-4-20(15)30-31(27,28)19-11-7-17(23)8-12-19/h1-13H,14H2,(H,25,26)
InChIK	WAPCYIMHAXRMHR-UHFFFAOYSA-N
TotalMolweight	479.339
Molweight	479.339
MonoisotopicMass	478.015697
CLogP	4.8674
CLogS	-5.747
H Acceptors	7
H Donors	1
TotalSurfaceArea	339.93
Relative PSA	0.24885
PolarSurfaceArea	102.44
Druglikeness	6.0282
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde
Shape Index	0.64516
Fragments	1
Non HAtoms	31
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	8
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	4
Symmetricatoms	5
StereoCon

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