(Z)-2-[1-(cyclobutanecarbonyl)indol-3-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

Formula:C23H17N2OF3 Mutagenic:none Tumorigenic:none Reproductive Effective:none (Z)-2-[1-(cyclobutanecarbonyl)indol-3-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile is not a drug-like molecule.

MolName	(Z)-2-[1-(cyclobutanecarbonyl)indol-3-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile
MolecularFormula	C23H17N2OF3
Smiles	N#C/C(/c1cn(C(C2CCC2)=O)c2c1cccc2)=C\c1ccc(C(F)(F)F)cc1
InChI	InChI=1S/C23H17F3N2O/c24-23(25,26)18-10-8-15(9-11-18)12-17(13-27)20-14-28(22(29)16-4-3-5-16)21-7-2-1-6-19(20)21/h1-2,6-12,14,16H,3-5H2
InChIK	ONPSXFHDVHIJDC-UHFFFAOYSA-N
TotalMolweight	394.395
Molweight	394.395
MonoisotopicMass	394.129297
CLogP	5.0424
CLogS	-5.801
H Acceptors	3
TotalSurfaceArea	290.73
Relative PSA	0.11512
PolarSurfaceArea	45.79
Druglikeness	-9.2352
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	3
Aromatic Atoms	15
Sp3Atoms	5
Symmetricatoms	5
Aromatic Nitrogens	1
StereoCon

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1 - (Z)-2-[1-(cyclobutanecarbonyl)indol-3-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile | 2 - (Z)-2-[1-(cyclobutanecarbonyl)indol-3-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enenitrile

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