UCSF

ZINC66123245

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 36 No

Popular Name: (6aS,10S,10aS,11aR)-10-(dimethylamino)-4,6,6a,9-tetrahydroxy-5,7-dioxo-1-phenyl-10a,11,11a,12-tetrah (6aS,10S,10aS,11aR)-10-(dimethyl…

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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) 0.28 1.61 -50.99 5 10 -1 177 490.492 3 ↓
Hi High (pH 8-9.5) 0.28 2.59 -106.12 4 10 -2 180 489.484 3 ↓
Mid Mid (pH 6-8) 0.28 3.67 -50.46 6 10 0 178 491.5 3 ↓

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

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