6-[(Z)-2-[2-[(2-fluorophenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione

Formula:C19H14N3O5F Mutagenic:none Tumorigenic:none Reproductive Effective:none 6-[(Z)-2-[2-[(2-fluorophenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione is a drug-like molecule.

MolName6-[(Z)-2-[2-[(2-fluorophenyl)methoxy]phenyl]ethenyl]-5-nitro-1H-pyrimidine-2,4-dione
MolecularFormulaC19H14N3O5F
Smiles[O-][N+](C(C(N1)=O)=C(/C=C\c(cccc2)c2OCc(cccc2)c2F)NC1=O)=O
InChIInChI=1S/C19H14FN3O5/c20-14-7-3-1-6-13(14)11-28-16-8-4-2-5-12(16)9-10-15-17(23(26)27)18(24)22-19(25)21-15/h1-10H,11H2,(H2,21,22,24,25)
InChIKGDQGEUVCDSEEQM-UHFFFAOYSA-N
TotalMolweight383.334
Molweight383.334
MonoisotopicMass383.09175
CLogP1.7449
CLogS-5.061
H Acceptors8
H Donors2
TotalSurfaceArea281.14
Relative PSA0.31806
PolarSurfaceArea113.25
Druglikeness-4.346
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.5
Fragments1
Non HAtoms28
NonCHAtoms9
Electronegative Atoms9
Rotatable Bond6
Rings Closures3
Small Rings3
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms3
Amides2
AcidicOxygens1
StereoCon

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