UCSF

ZINC69482545

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Substance Information

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

Popular Name: (1S,3aS,5aR,5bR,7aS,9S,11aR,11bR,13aS,13bS)-9-hydroxy-1-isopropyl-5a,5b,8,8,11a-pentamethyl-1,2,3,4, (1S,3aS,5aR,5bR,7aS,9S,11aR,11bR…

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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) 7.73 11.95 -55.66 1 3 -1 60 457.719 2 ↓
Lo Low (pH 4.5-6) 7.73 10.09 -6.61 2 3 0 58 458.727 2 ↓

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

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