2-[(2Z)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-4-hydroxy-1H-pyrimidin-6-one

Formula:C11H9N4O2F Mutagenic:none Tumorigenic:none Reproductive Effective:none 2-[(2Z)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-4-hydroxy-1H-pyrimidin-6-one is a drug-like molecule.

MolName2-[(2Z)-2-[(4-fluorophenyl)methylidene]hydrazinyl]-4-hydroxy-1H-pyrimidin-6-one
MolecularFormulaC11H9N4O2F
SmilesOC(N=C(N/N=C\c(cc1)ccc1F)N1)=CC1=O
InChIInChI=1S/C11H9FN4O2/c12-8-3-1-7(2-4-8)6-13-16-11-14-9(17)5-10(18)15-11/h1-6H,(H3,14,15,16,17,18)
InChIKGGZDJSFGJSNWGC-UHFFFAOYSA-N
TotalMolweight248.216
Molweight248.216
MonoisotopicMass248.070954
CLogP1.213
CLogS-4.713
H Acceptors6
H Donors3
TotalSurfaceArea185.57
Relative PSA0.38842
PolarSurfaceArea86.08
Druglikeness1.5506
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functionspolar activated DB; imine/hydrazone of aldehyde
Shape Index0.66667
Fragments1
Non HAtoms18
NonCHAtoms7
Electronegative Atoms7
Rotatable Bond2
Rings Closures2
Small Rings2
Aromatic Rings1
Aromatic Atoms6
Sp3Atoms1
Symmetricatoms2
Amides1
BasicNitrogens1
StereoCon

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