[(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 2-chlorobenzoate

Formula:C22H13N2O3Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:none [(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 2-chlorobenzoate is not a drug-like molecule.

MolName	[(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 2-chlorobenzoate
MolecularFormula	C22H13N2O3Cl3
Smiles	O=C(c(cccc1)c1Cl)O/N=C(\c(cccc1)c1N1Cc(ccc(Cl)c2)c2Cl)/C1=O
InChI	InChI=1S/C22H13Cl3N2O3/c23-14-10-9-13(18(25)11-14)12-27-19-8-4-2-6-16(19)20(21(27)28)26-30-22(29)15-5-1-3-7-17(15)24/h1-11H,12H2
InChIK	WJTBPOUHYAAKBO-UHFFFAOYSA-N
TotalMolweight	459.715
Molweight	459.715
MonoisotopicMass	457.999174
CLogP	6.1377
CLogS	-7.526
H Acceptors	5
TotalSurfaceArea	318.07
Relative PSA	0.16078
PolarSurfaceArea	58.97
Druglikeness	1.9724
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53333
Fragments	1
Non HAtoms	30
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	3
Aromatic Atoms	18
Sp3Atoms	2
Amides	1
StereoCon

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1 - [(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 2-chlorobenzoate | 2 - [(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 2-chlorobenzoate

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