UCSF

ZINC35494028

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2009 33 No

Popular Name: (1R,3aS,5aR,5bR,7aR,11aR,11bR,13aS,13bS)-1-isopropenyl-5a,5b,8,8,11a-pentamethyl-9-oxo-2,3,4,5,6,7,7 (1R,3aS,5aR,5bR,7aR,11aR,11bR,13…

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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) 6.86 14.3 -54.01 0 3 -1 57 453.687 2 ↓
Lo Low (pH 4.5-6) 6.86 12.32 -7.48 1 3 0 54 454.695 2 ↓

Activity (Go SEA)

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