(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-1-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-en-1-one

Formula:C26H15NO3Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-1-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-3-[5-(3,4-dichlorophenyl)furan-2-yl]-1-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-en-1-one
MolecularFormula	C26H15NO3Cl2
Smiles	O=C(/C=C/c1ccc(-c(cc2)cc(Cl)c2Cl)o1)c1cc2c(-c3ccccc3)onc2cc1
InChI	InChI=1S/C26H15Cl2NO3/c27-21-10-6-18(15-22(21)28)25-13-9-19(31-25)8-12-24(30)17-7-11-23-20(14-17)26(32-29-23)16-4-2-1-3-5-16/h1-15H
InChIK	OIKPHVQNXZZWQS-UHFFFAOYSA-N
TotalMolweight	460.315
Molweight	460.315
MonoisotopicMass	459.042898
CLogP	6.9321
CLogS	-9.148
H Acceptors	4
TotalSurfaceArea	340.37
Relative PSA	0.15345
PolarSurfaceArea	56.24
Druglikeness	3.7933
Mutagenic	high
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.59375
Fragments	1
Non HAtoms	32
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	5
Rings Closures	5
Small Rings	5
Aromatic Rings	5
Aromatic Atoms	26
Symmetricatoms	2
Aromatic Nitrogens	1
StereoCon

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