2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-4-chlorophenoxy]-N-(3,4-dichlorophenyl)acetamide

Formula:C24H15N4O2Cl3 Mutagenic:none Tumorigenic:none Reproductive Effective:high 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-4-chlorophenoxy]-N-(3,4-dichlorophenyl)acetamide is not a drug-like molecule.

MolName	2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-4-chlorophenoxy]-N-(3,4-dichlorophenyl)acetamide
MolecularFormula	C24H15N4O2Cl3
Smiles	N#C/C(/c1nc(cccc2)c2[nH]1)=C\c(cc(cc1)Cl)c1OCC(Nc(cc1)cc(Cl)c1Cl)=O
InChI	InChI=1S/C24H15Cl3N4O2/c25-16-5-8-22(33-13-23(32)29-17-6-7-18(26)19(27)11-17)14(10-16)9-15(12-28)24-30-20-3-1-2-4-21(20)31-24/h1-11H,13H2,(H,29,32)(H,30,31)
InChIK	RKMZOSSJPZPVFV-UHFFFAOYSA-N
TotalMolweight	497.768
Molweight	497.768
MonoisotopicMass	496.026057
CLogP	5.3621
CLogS	-6.624
H Acceptors	6
H Donors	2
TotalSurfaceArea	361.36
Relative PSA	0.20207
PolarSurfaceArea	90.8
Druglikeness	-2.6203
Mutagenic	none
Tumorigenic	none
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.54545
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	6
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Amides	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-4-chlorophenoxy]-N-(3,4-dichlorophenyl)acetamide | 2 - 2-[2-[(E)-2-(1H-benzimidazol-2-yl)-2-cyanoethenyl]-4-chlorophenoxy]-N-(3,4-dichlorophenyl)acetamide

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