(E)-1-[3-[(2,4-dichlorophenyl)methoxy]phenyl]-3-(4-phenoxyanilino)prop-2-en-1-one

Formula:C28H21NO3Cl2 Mutagenic:none Tumorigenic:none Reproductive Effective:none (E)-1-[3-[(2,4-dichlorophenyl)methoxy]phenyl]-3-(4-phenoxyanilino)prop-2-en-1-one is not a drug-like molecule.

MolName	(E)-1-[3-[(2,4-dichlorophenyl)methoxy]phenyl]-3-(4-phenoxyanilino)prop-2-en-1-one
MolecularFormula	C28H21NO3Cl2
Smiles	O=C(/C=C/Nc(cc1)ccc1Oc1ccccc1)c1cccc(OCc(ccc(Cl)c2)c2Cl)c1
InChI	InChI=1S/C28H21Cl2NO3/c29-22-10-9-21(27(30)18-22)19-33-26-8-4-5-20(17-26)28(32)15-16-31-23-11-13-25(14-12-23)34-24-6-2-1-3-7-24/h1-18,31H,19H2
InChIK	BPTYRDFLOAZMJQ-UHFFFAOYSA-N
TotalMolweight	490.385
Molweight	490.385
MonoisotopicMass	489.089848
CLogP	6.4302
CLogS	-8.896
H Acceptors	4
H Donors	1
TotalSurfaceArea	372.85
Relative PSA	0.11935
PolarSurfaceArea	47.56
Druglikeness	0.40124
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.67647
Fragments	1
Non HAtoms	34
NonCHAtoms	6
Electronegative Atoms	6
Rotatable Bond	9
Rings Closures	4
Small Rings	4
Aromatic Rings	4
Aromatic Atoms	24
Sp3Atoms	3
Symmetricatoms	4
StereoCon

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