5-nitro-6-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1H-pyrimidine-2,4-dione

Formula:C17H10N3O5F3 Mutagenic:low Tumorigenic:high Reproductive Effective:none 5-nitro-6-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1H-pyrimidine-2,4-dione is a drug-like molecule.

MolName	5-nitro-6-[(E)-2-[5-[3-(trifluoromethyl)phenyl]furan-2-yl]ethenyl]-1H-pyrimidine-2,4-dione
MolecularFormula	C17H10N3O5F3
Smiles	[O-][N+](C(C(N1)=O)=C(/C=C/c2ccc(-c3cccc(C(F)(F)F)c3)o2)NC1=O)=O
InChI	InChI=1S/C17H10F3N3O5/c18-17(19,20)10-3-1-2-9(8-10)13-7-5-11(28-13)4-6-12-14(23(26)27)15(24)22-16(25)21-12/h1-8H,(H2,21,22,24,25)
InChIK	NEMDOYZLNBBOSV-UHFFFAOYSA-N
TotalMolweight	393.276
Molweight	393.276
MonoisotopicMass	393.057256
CLogP	2.0832
CLogS	-5.644
H Acceptors	8
H Donors	2
TotalSurfaceArea	270.18
Relative PSA	0.34618
PolarSurfaceArea	117.16
Druglikeness	-8.8076
Mutagenic	low
Tumorigenic	high
Reproductive Effective	none
Irritant	none
Nasty Functions
Shape Index	0.5
Fragments	1
Non HAtoms	28
NonCHAtoms	11
Electronegative Atoms	11
Rotatable Bond	5
Rings Closures	3
Small Rings	3
Aromatic Rings	2
Aromatic Atoms	11
Sp3Atoms	2
Symmetricatoms	2
Amides	2
AcidicOxygens	1
StereoCon

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