(4Z)-4-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]methylidene]-2-phenyl-1,3-oxazol-5-one

Formula:C24H13N3O2ClF3 Mutagenic:none Tumorigenic:high Reproductive Effective:low (4Z)-4-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]methylidene]-2-phenyl-1,3-oxazol-5-one is not a drug-like molecule.

MolName	(4Z)-4-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]methylidene]-2-phenyl-1,3-oxazol-5-one
MolecularFormula	C24H13N3O2ClF3
Smiles	O=C1OC(c2ccccc2)=N/C1=C\c(c1c2cccc1)cn2-c(ncc(C(F)(F)F)c1)c1Cl
InChI	InChI=1S/C24H13ClF3N3O2/c25-18-11-16(24(26,27)28)12-29-21(18)31-13-15(17-8-4-5-9-20(17)31)10-19-23(32)33-22(30-19)14-6-2-1-3-7-14/h1-13H
InChIK	IEMLXCNCOULQJW-UHFFFAOYSA-N
TotalMolweight	467.833
Molweight	467.833
MonoisotopicMass	467.064838
CLogP	5.987
CLogS	-7.567
H Acceptors	5
TotalSurfaceArea	322.15
Relative PSA	0.16263
PolarSurfaceArea	56.48
Druglikeness	-5.3283
Mutagenic	none
Tumorigenic	high
Reproductive Effective	low
Irritant	high
Nasty Functions
Shape Index	0.51515
Fragments	1
Non HAtoms	33
NonCHAtoms	9
Electronegative Atoms	9
Rotatable Bond	4
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	21
Sp3Atoms	2
Symmetricatoms	4
Aromatic Nitrogens	2
BasicNitrogens	1
StereoCon

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1 - (4Z)-4-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]methylidene]-2-phenyl-1,3-oxazol-5-one | 2 - (4Z)-4-[[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]methylidene]-2-phenyl-1,3-oxazol-5-one

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