UCSF

ZINC40410123

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2010 35 No

Popular Name: [(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[3-hydroxy-2-[3-(4-hydroxyphenyl)propanoyl]-5-methoxy-phenoxy]-6-( [(2S,3R,4S,5S,6R)-4,5-dihydroxy-…

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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) 1.64 -0.67 -23.38 5 11 0 172 492.477 10 ↓
Hi High (pH 8-9.5) 1.64 0.06 -56.11 4 11 -1 175 491.469 10 ↓

Activity (Go SEA)

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