2-[(E)-2-(2,4-dichlorophenyl)ethenyl]-1-[(2,5-dichlorophenyl)methyl]benzimidazole

Formula:C22H14N2Cl4 Mutagenic:none Tumorigenic:high Reproductive Effective:high 2-[(E)-2-(2,4-dichlorophenyl)ethenyl]-1-[(2,5-dichlorophenyl)methyl]benzimidazole is not a drug-like molecule.

MolName	2-[(E)-2-(2,4-dichlorophenyl)ethenyl]-1-[(2,5-dichlorophenyl)methyl]benzimidazole
MolecularFormula	C22H14N2Cl4
Smiles	Clc(cc1)cc(Cn2c(cccc3)c3nc2/C=C/c(ccc(Cl)c2)c2Cl)c1Cl
InChI	InChI=1S/C22H14Cl4N2/c23-16-8-9-18(25)15(11-16)13-28-21-4-2-1-3-20(21)27-22(28)10-6-14-5-7-17(24)12-19(14)26/h1-12H,13H2
InChIK	UUNIYAJSUVHPGO-UHFFFAOYSA-N
TotalMolweight	448.179
Molweight	448.179
MonoisotopicMass	445.991106
CLogP	7.27
CLogS	-6.644
H Acceptors	2
TotalSurfaceArea	317.28
Relative PSA	0.056228
PolarSurfaceArea	17.82
Druglikeness	2.0768
Mutagenic	none
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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