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

Formula:C24H13O3Cl2F3 Mutagenic:high Tumorigenic:high Reproductive Effective:none (E)-3-[5-(2,3-dichlorophenyl)furan-2-yl]-1-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one is not a drug-like molecule.

MolName(E)-3-[5-(2,3-dichlorophenyl)furan-2-yl]-1-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]prop-2-en-1-one
MolecularFormulaC24H13O3Cl2F3
SmilesO=C(/C=C/c1ccc(-c2cccc(Cl)c2Cl)o1)c1ccc(-c2cc(C(F)(F)F)ccc2)o1
InChIInChI=1S/C24H13Cl2F3O3/c25-18-6-2-5-17(23(18)26)21-10-8-16(31-21)7-9-19(30)22-12-11-20(32-22)14-3-1-4-15(13-14)24(27,28)29/h1-13H
InChIKMNLKNIPMWQVSPA-UHFFFAOYSA-N
TotalMolweight477.264
Molweight477.264
MonoisotopicMass476.019383
CLogP7.2419
CLogS-9.01
H Acceptors3
TotalSurfaceArea336.47
Relative PSA0.12263
PolarSurfaceArea43.35
Druglikeness-5.0703
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5625
Fragments1
Non HAtoms32
NonCHAtoms8
Electronegative Atoms8
Rotatable Bond6
Rings Closures4
Small Rings4
Aromatic Rings4
Aromatic Atoms22
Sp3Atoms1
Symmetricatoms2
StereoCon

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