(4Z)-4-[[1-[(4-bromophenyl)methyl]-3-phenylpyrazol-4-yl]methylidene]-2-phenyl-1,3-oxazol-5-one

Formula:C26H18N3O2Br Mutagenic:none Tumorigenic:none Reproductive Effective:none (4Z)-4-[[1-[(4-bromophenyl)methyl]-3-phenylpyrazol-4-yl]methylidene]-2-phenyl-1,3-oxazol-5-one is a drug-like molecule.

MolName	(4Z)-4-[[1-[(4-bromophenyl)methyl]-3-phenylpyrazol-4-yl]methylidene]-2-phenyl-1,3-oxazol-5-one
MolecularFormula	C26H18N3O2Br
Smiles	O=C1OC(c2ccccc2)=N/C1=C\c1cn(Cc(cc2)ccc2Br)nc1-c1ccccc1
InChI	InChI=1S/C26H18BrN3O2/c27-22-13-11-18(12-14-22)16-30-17-21(24(29-30)19-7-3-1-4-8-19)15-23-26(31)32-25(28-23)20-9-5-2-6-10-20/h1-15,17H,16H2
InChIK	FQWSWBILSBZPPS-UHFFFAOYSA-N
TotalMolweight	484.352
Molweight	484.352
MonoisotopicMass	483.058238
CLogP	4.487
CLogS	-6.088
H Acceptors	5
TotalSurfaceArea	334.82
Relative PSA	0.15647
PolarSurfaceArea	56.48
Druglikeness	2.1267
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53125
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	23
Sp3Atoms	2
Symmetricatoms	6
Aromatic Nitrogens	2
StereoCon

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