2-chloro-N-[(E)-1-(4-fluorophenyl)-3-(4-iodoanilino)-3-oxoprop-1-en-2-yl]benzamide

Formula:C22H15N2O2ClFI Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-chloro-N-[(E)-1-(4-fluorophenyl)-3-(4-iodoanilino)-3-oxoprop-1-en-2-yl]benzamide is not a drug-like molecule.

MolName	2-chloro-N-[(E)-1-(4-fluorophenyl)-3-(4-iodoanilino)-3-oxoprop-1-en-2-yl]benzamide
MolecularFormula	C22H15N2O2ClFI
Smiles	O=C(/C(/NC(c(cccc1)c1Cl)=O)=C\c(cc1)ccc1F)Nc(cc1)ccc1I
InChI	InChI=1S/C22H15ClFIN2O2/c23-19-4-2-1-3-18(19)21(28)27-20(13-14-5-7-15(24)8-6-14)22(29)26-17-11-9-16(25)10-12-17/h1-13H,(H,26,29)(H,27,28)
InChIK	UGMSOMZLWFPQKM-UHFFFAOYSA-N
TotalMolweight	520.724
Molweight	520.724
MonoisotopicMass	519.985081
CLogP	5.5677
CLogS	-6.939
H Acceptors	4
H Donors	2
TotalSurfaceArea	323.96
Relative PSA	0.15125
PolarSurfaceArea	58.2
Druglikeness	2.193
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.48276
Fragments	1
Non HAtoms	29
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	3
Aromatic Atoms	18
Symmetricatoms	4
Amides	2
StereoCon

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