UCSF

ZINC49021710

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 22nd, 2010 32 No

Popular Name: [(2S,3R,4S,5R)-5-[2-[(2-chlorophenyl)methylsulfanyl]-6-hydroxy-purin-9-yl]-3,4-dihydroxy-tetrahydrof [(2S,3R,4S,5R)-5-[2-[(2-chloroph…

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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) 1.67 0.45 -216.02 2 12 -3 189 501.821 7 ↓
Mid Mid (pH 6-8) 1.67 -0.69 -112.91 3 12 -2 186 502.829 7 ↓
Mid Mid (pH 6-8) 1.21 1.25 -58.95 4 12 -1 183 503.837 7 ↓

Activity (Go SEA)

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