UCSF

ZINC22065518

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 23 No

Popular Name: (1R,3aS,3bS,5aR,9aR,9bS,11aS)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[ (1R,3aS,3bS,5aR,9aR,9bS,11aS)-9a…

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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) 2.95 6.73 -57.05 1 4 -1 69 316.421 1 ↓
Lo Low (pH 4.5-6) 2.95 5.61 -13.52 2 4 0 66 317.429 1 ↓

Activity (Go SEA)

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