(E)-2-(1H-benzimidazol-2-yl)-3-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]prop-2-enenitrile

Formula:C23H15N3OClF Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-2-(1H-benzimidazol-2-yl)-3-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]prop-2-enenitrile is a drug-like molecule.

MolName	(E)-2-(1H-benzimidazol-2-yl)-3-[2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]prop-2-enenitrile
MolecularFormula	C23H15N3OClF
Smiles	N#C/C(/c1nc(cccc2)c2[nH]1)=C\c(cccc1)c1OCc(c(F)ccc1)c1Cl
InChI	InChI=1S/C23H15ClFN3O/c24-18-7-5-8-19(25)17(18)14-29-22-11-4-1-6-15(22)12-16(13-26)23-27-20-9-2-3-10-21(20)28-23/h1-12H,14H2,(H,27,28)
InChIK	FCDCAKRXPLUNJQ-UHFFFAOYSA-N
TotalMolweight	403.843
Molweight	403.843
MonoisotopicMass	403.088767
CLogP	4.8766
CLogS	-5.515
H Acceptors	4
H Donors	1
TotalSurfaceArea	307.66
Relative PSA	0.15771
PolarSurfaceArea	61.7
Druglikeness	-5.259
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.51724
Fragments	1
Non HAtoms	29
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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