4-amino-5-fluoro-1-[(2R,5R)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one

Formula:C9H10N3O3F Mutagenic:none Tumorigenic:none Reproductive Effective:none 4-amino-5-fluoro-1-[(2R,5R)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one is a drug-like molecule.

MolName4-amino-5-fluoro-1-[(2R,5R)-5-(hydroxymethyl)-2,5-dihydrofuran-2-yl]pyrimidin-2-one
MolecularFormulaC9H10N3O3F
SmilesNC(C(F)=CN1[C@@H]2O[C@@H](CO)C=C2)=NC1=O
InChIInChI=1S/C9H10FN3O3/c10-6-3-13(9(15)12-8(6)11)7-2-1-5(4-14)16-7/h1-3,5,7,14H,4H2,(H2,11,12,15)/t5-,7+/m0/s1
InChIKHSBKFSPNDWWPSL-CAHLUQPWSA-N
TotalMolweight227.194
Molweight227.194
MonoisotopicMass227.07062
CLogP-1.4045
CLogS-1.814
H Acceptors6
H Donors2
TotalSurfaceArea158.71
Relative PSA0.41881
PolarSurfaceArea88.15
Druglikeness-1.1565
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.625
Fragments1
Non HAtoms16
NonCHAtoms7
Electronegative Atoms7
StereoCenters2
Rotatable Bond2
Rings Closures2
Small Rings2
Sp3Atoms5
Amides1
BasicNitrogens1
StereoConthis enantiomer

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