4,6-bis[(E)-2-(2-iodophenyl)ethenyl]-1H-pyrimidin-2-one

Formula:C20H14N2OI2 Mutagenic:none Tumorigenic:none Reproductive Effective:none 4,6-bis[(E)-2-(2-iodophenyl)ethenyl]-1H-pyrimidin-2-one is not a drug-like molecule.

MolName	4,6-bis[(E)-2-(2-iodophenyl)ethenyl]-1H-pyrimidin-2-one
MolecularFormula	C20H14N2OI2
Smiles	O=C1N=C(/C=C/c(cccc2)c2I)C=C(/C=C/c(cccc2)c2I)N1
InChI	InChI=1S/C20H14I2N2O/c21-18-7-3-1-5-14(18)9-11-16-13-17(24-20(25)23-16)12-10-15-6-2-4-8-19(15)22/h1-13H,(H,23,24,25)
InChIK	UQVPXZYTECPEGO-UHFFFAOYSA-N
TotalMolweight	552.144
Molweight	552.144
MonoisotopicMass	551.919559
CLogP	4.9891
CLogS	-7.131
H Acceptors	3
H Donors	1
TotalSurfaceArea	301.97
Relative PSA	0.11925
PolarSurfaceArea	41.46
Druglikeness	2.2605
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.6
Fragments	1
Non HAtoms	25
NonCHAtoms	5
Electronegative Atoms	5
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	12
Amides	1
BasicNitrogens	1
StereoCon

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