(4E)-2-naphthalen-1-yl-4-[(3-phenylmethoxyphenyl)methylidene]-1,3-oxazol-5-one

Formula:C27H19NO3 Mutagenic:low Tumorigenic:high Reproductive Effective:none (4E)-2-naphthalen-1-yl-4-[(3-phenylmethoxyphenyl)methylidene]-1,3-oxazol-5-one is not a drug-like molecule.

MolName	(4E)-2-naphthalen-1-yl-4-[(3-phenylmethoxyphenyl)methylidene]-1,3-oxazol-5-one
MolecularFormula	C27H19NO3
Smiles	O=C1OC(c2cccc3ccccc23)=N/C1=C/c1cc(OCc2ccccc2)ccc1
InChI	InChI=1S/C27H19NO3/c29-27-25(28-26(31-27)24-15-7-12-21-11-4-5-14-23(21)24)17-20-10-6-13-22(16-20)30-18-19-8-2-1-3-9-19/h1-17H,18H2
InChIK	MEMVVNOAVPCWLM-UHFFFAOYSA-N
TotalMolweight	405.452
Molweight	405.452
MonoisotopicMass	405.136494
CLogP	5.1343
CLogS	-6.866
H Acceptors	4
TotalSurfaceArea	313.07
Relative PSA	0.1423
PolarSurfaceArea	47.89
Druglikeness	0.70705
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.58065
Fragments	1
Non HAtoms	31
NonCHAtoms	4
Electronegative Atoms	4
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	4
Aromatic Atoms	22
Sp3Atoms	3
Symmetricatoms	2
StereoCon

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