[(E)-2-[1-[2-(2-chlorophenoxy)ethyl]benzimidazol-2-yl]-1-(3-fluorophenyl)ethenyl] 3-fluorobenzoate

Formula:C30H21N2O3ClF2 Mutagenic:none Tumorigenic:none Reproductive Effective:none [(E)-2-[1-[2-(2-chlorophenoxy)ethyl]benzimidazol-2-yl]-1-(3-fluorophenyl)ethenyl] 3-fluorobenzoate is not a drug-like molecule.

MolName	[(E)-2-[1-[2-(2-chlorophenoxy)ethyl]benzimidazol-2-yl]-1-(3-fluorophenyl)ethenyl] 3-fluorobenzoate
MolecularFormula	C30H21N2O3ClF2
Smiles	O=C(c1cc(F)ccc1)O/C(/c1cc(F)ccc1)=C/c1nc(cccc2)c2n1CCOc(cccc1)c1Cl
InChI	InChI=1S/C30H21ClF2N2O3/c31-24-11-1-4-14-27(24)37-16-15-35-26-13-3-2-12-25(26)34-29(35)19-28(20-7-5-9-22(32)17-20)38-30(36)21-8-6-10-23(33)18-21/h1-14,17-19H,15-16H2
InChIK	IOVJJLQEDGHQHC-UHFFFAOYSA-N
TotalMolweight	530.957
Molweight	530.957
MonoisotopicMass	530.120876
CLogP	6.7941
CLogS	-6.342
H Acceptors	5
TotalSurfaceArea	393.2
Relative PSA	0.1294
PolarSurfaceArea	53.35
Druglikeness	1.2279
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	low
Nasty Functions
Shape Index	0.44737
Fragments	1
Non HAtoms	38
NonCHAtoms	8
Electronegative Atoms	8
Rotatable Bond	9
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	27
Sp3Atoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - [(E)-2-[1-[2-(2-chlorophenoxy)ethyl]benzimidazol-2-yl]-1-(3-fluorophenyl)ethenyl] 3-fluorobenzoate | 2 - [(E)-2-[1-[2-(2-chlorophenoxy)ethyl]benzimidazol-2-yl]-1-(3-fluorophenyl)ethenyl] 3-fluorobenzoate

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