UCSF

ZINC69482553

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 25th, 2011 33 No

Popular Name: (1S,2R,4aS,6aS,6aR,8aS,12aR,14aS,14bS)-1,2,6a,9,9,12a,14a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,8,8a,11, (1S,2R,4aS,6aS,6aR,8aS,12aR,14aS…

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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) 6.60 14.95 -53.78 0 3 -1 57 453.687 1 ↓
Lo Low (pH 4.5-6) 6.60 12.86 -7.1 1 3 0 54 454.695 1 ↓

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

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