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

Formula:C19H15N2O3Cl3 Mutagenic:high Tumorigenic:high Reproductive Effective:high [(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 4-chlorobutanoate is not a drug-like molecule.

MolName[(E)-[1-[(2,4-dichlorophenyl)methyl]-2-oxoindol-3-ylidene]amino] 4-chlorobutanoate
MolecularFormulaC19H15N2O3Cl3
SmilesO=C(CCCCl)O/N=C(\c(cccc1)c1N1Cc(ccc(Cl)c2)c2Cl)/C1=O
InChIInChI=1S/C19H15Cl3N2O3/c20-9-3-6-17(25)27-23-18-14-4-1-2-5-16(14)24(19(18)26)11-12-7-8-13(21)10-15(12)22/h1-2,4-5,7-8,10H,3,6,9,11H2
InChIKJVYSZPGLAQFWAX-UHFFFAOYSA-N
TotalMolweight425.698
Molweight425.698
MonoisotopicMass424.014824
CLogP5.226
CLogS-6.561
H Acceptors5
TotalSurfaceArea299.59
Relative PSA0.1707
PolarSurfaceArea58.97
Druglikeness-6.0448
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritantnone
Nasty Functions
Shape Index0.59259
Fragments1
Non HAtoms27
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond7
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms5
Amides1
StereoCon

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