[3-[(Z)-[[2-(2,3-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate

Formula:C22H13N3O4Cl4 Mutagenic:none Tumorigenic:none Reproductive Effective:none [3-[(Z)-[[2-(2,3-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate is not a drug-like molecule.

MolName	[3-[(Z)-[[2-(2,3-dichloroanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] 2,4-dichlorobenzoate
MolecularFormula	C22H13N3O4Cl4
Smiles	O=C(C(N/N=C\c1cc(OC(c(ccc(Cl)c2)c2Cl)=O)ccc1)=O)Nc1cccc(Cl)c1Cl
InChI	InChI=1S/C22H13Cl4N3O4/c23-13-7-8-15(17(25)10-13)22(32)33-14-4-1-3-12(9-14)11-27-29-21(31)20(30)28-18-6-2-5-16(24)19(18)26/h1-11H,(H,28,30)(H,29,31)
InChIK	RVHWRFIRGNWFQG-UHFFFAOYSA-N
TotalMolweight	525.174
Molweight	525.174
MonoisotopicMass	522.966015
CLogP	5.9984
CLogS	-7.939
H Acceptors	7
H Donors	2
TotalSurfaceArea	365.39
Relative PSA	0.22866
PolarSurfaceArea	96.86
Druglikeness	3.4163
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions	acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide
Shape Index	0.60606
Fragments	1
Non HAtoms	33
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	7
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	1
Amides	1
StereoCon

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