(4E)-4-[(2-chlorophenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one

Formula:C18H12NO2Cl Mutagenic:none Tumorigenic:high Reproductive Effective:none (4E)-4-[(2-chlorophenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4E)-4-[(2-chlorophenyl)methylidene]-2-[(E)-2-phenylethenyl]-1,3-oxazol-5-one
MolecularFormula	C18H12NO2Cl
Smiles	O=C1OC(/C=C/c2ccccc2)=N/C1=C/c(cccc1)c1Cl
InChI	InChI=1S/C18H12ClNO2/c19-15-9-5-4-8-14(15)12-16-18(21)22-17(20-16)11-10-13-6-2-1-3-7-13/h1-12H
InChIK	LSHFLRQQOZHBNO-UHFFFAOYSA-N
TotalMolweight	309.751
Molweight	309.751
MonoisotopicMass	309.055656
CLogP	3.5523
CLogS	-5.025
H Acceptors	3
TotalSurfaceArea	236.87
Relative PSA	0.14586
PolarSurfaceArea	38.66
Druglikeness	0.9962
Mutagenic	none
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.63636
Fragments	1
Non HAtoms	22
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	3
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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