UCSF

ZINC12406768

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2008 17 No

Popular Name: (5R)-1-[(2R,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-hexahydropyrimidine-2,4 (5R)-1-[(2R,4R,5R)-4-hydroxy-5-(…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.72 -4.09 -17.39 3 7 0 99 244.247 2 ↓
Hi High (pH 8-9.5) -1.65 -7.28 -56.41 2 7 -1 105 243.239 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0626970A1; US4980460; US5179200; US5204456; WO1994014831A1 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )