(4E)-4-benzylidene-2-(2-bromophenyl)-1,3-oxazol-5-one

Formula:C16H10NO2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none (4E)-4-benzylidene-2-(2-bromophenyl)-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4E)-4-benzylidene-2-(2-bromophenyl)-1,3-oxazol-5-one
MolecularFormula	C16H10NO2Br
Smiles	O=C1OC(c(cccc2)c2Br)=N/C1=C/c1ccccc1
InChI	InChI=1S/C16H10BrNO2/c17-13-9-5-4-8-12(13)15-18-14(16(19)20-15)10-11-6-2-1-3-7-11/h1-10H
InChIK	LJDTVODLOJLOOW-UHFFFAOYSA-N
TotalMolweight	328.164
Molweight	328.164
MonoisotopicMass	326.98949
CLogP	3.317
CLogS	-4.753
H Acceptors	3
TotalSurfaceArea	213.58
Relative PSA	0.16177
PolarSurfaceArea	38.66
Druglikeness	-0.95291
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	20
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	2
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Sp3Atoms	1
Symmetricatoms	2
StereoCon

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