UCSF

ZINC66124054

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 34 No

Popular Name: (2S,4aS,6aR,6bS,8aR,10S,12aS,14aS,14bS)-10-hydroxy-2,4a,6a,6b,9,9,12a-heptamethyl-14-oxo-3,4,5,6,7,8 (2S,4aS,6aR,6bS,8aR,10S,12aS,14a…

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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) 5.62 11.61 -66.46 1 4 -1 77 469.686 1 ↓
Lo Low (pH 4.5-6) 5.62 9.61 -15.39 2 4 0 75 470.694 1 ↓

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Rings

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

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