UCSF

ZINC36338529

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2009 26 No

Popular Name: [(2S,3S,4R,5R)-5-[2-[(E)-2-fluorovinyl]-6-hydroxy-purin-9-yl]-3,4-dihydroxy-tetrahydrofuran-2-yl]met [(2S,3S,4R,5R)-5-[2-[(E)-2-fluor…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

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) -1.88 -1.66 -152.11 3 12 -2 186 390.22 5 ↓
Hi High (pH 8-9.5) -1.42 -3.56 -210.84 2 12 -3 189 389.212 5 ↓
Mid Mid (pH 6-8) -1.88 -2.81 -60.84 4 12 -1 183 391.228 5 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.