UCSF

ZINC34643432

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 34 No

Popular Name: (1R,3aS,5aR,5bR,7R,7aR,11aR,11bR,13aR,13bS)-1-acetyl-7-hydroxy-5a,5b,8,8,11a-pentamethyl-9-oxo-2,3,4 (1R,3aS,5aR,5bR,7R,7aR,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) 4.30 10.91 -44.35 1 5 -1 94 471.658 2 ↓
Lo Low (pH 4.5-6) 4.30 9.22 -10.66 2 5 0 92 472.666 2 ↓

Activity (Go SEA)

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