2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(2,6-dichlorophenyl)methyl]benzimidazole

Formula:C22H15N2Cl3 Mutagenic:none Tumorigenic:high Reproductive Effective:none 2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(2,6-dichlorophenyl)methyl]benzimidazole is not a drug-like molecule.

MolName	2-[(E)-2-(2-chlorophenyl)ethenyl]-1-[(2,6-dichlorophenyl)methyl]benzimidazole
MolecularFormula	C22H15N2Cl3
Smiles	Clc1cccc(Cl)c1Cn1c(cccc2)c2nc1/C=C/c(cccc1)c1Cl
InChI	InChI=1S/C22H15Cl3N2/c23-17-7-2-1-6-15(17)12-13-22-26-20-10-3-4-11-21(20)27(22)14-16-18(24)8-5-9-19(16)25/h1-13H,14H2
InChIK	JUTJUUIMNXKFKD-UHFFFAOYSA-N
TotalMolweight	413.734
Molweight	413.734
MonoisotopicMass	412.030079
CLogP	6.664
CLogS	-5.908
H Acceptors	2
TotalSurfaceArea	301.86
Relative PSA	0.0591
PolarSurfaceArea	17.82
Druglikeness	2.0768
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48148
Fragments	1
Non HAtoms	27
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	1
Symmetricatoms	3
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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