6-[(E)-2-[5-(2,4-difluorophenyl)furan-2-yl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Formula:C16H9N3O5F2 Mutagenic:low Tumorigenic:high Reproductive Effective:none 6-[(E)-2-[5-(2,4-difluorophenyl)furan-2-yl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione is a drug-like molecule.

MolName	6-[(E)-2-[5-(2,4-difluorophenyl)furan-2-yl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
MolecularFormula	C16H9N3O5F2
Smiles	[O-][N+](C(C(N1)=O)=C(/C=C/c2ccc(-c(ccc(F)c3)c3F)o2)NC1=O)=O
InChI	InChI=1S/C16H9F2N3O5/c17-8-1-4-10(11(18)7-8)13-6-3-9(26-13)2-5-12-14(21(24)25)15(22)20-16(23)19-12/h1-7H,(H2,19,20,22,23)
InChIK	JUEIOLTWCYMWNL-UHFFFAOYSA-N
TotalMolweight	361.259
Molweight	361.259
MonoisotopicMass	361.051028
CLogP	1.4365
CLogS	-5.494
H Acceptors	8
H Donors	2
TotalSurfaceArea	253.42
Relative PSA	0.36907
PolarSurfaceArea	117.16
Druglikeness	-2.9576
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.53846
Fragments	1
Non HAtoms	26
NonCHAtoms	10
Electronegative Atoms	10
Rotatable Bond	4
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	1
Amides	2
AcidicOxygens	1
StereoCon

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