UCSF

ZINC05163028

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2006 20 No

Popular Name: 3-(6-Amino-9H-purin-9-yl)-1-(hydroxymethyl)-6-oxabicyclo(3.1.0)hexane-2,4-diol; 6-Oxabicyclo(3.1.0)hexane-2,4-diol, 3-(6-amino-9H-purin-9-yl)-1-(hydroxymethyl)-; LS-98796; Neplanocin B 3-(6-Amino-9H-purin-9-yl)-1-(hyd…

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Annotations

Vendors

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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) -1.88 -5.48 -19.3 5 9 0 143 279.256 2 ↓
Lo Low (pH 4.5-6) -1.88 -5.02 -45.44 6 9 1 144 280.264 2 ↓

Activity (Go SEA)

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