UCSF

ZINC13783444

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 25th, 2008 32 No

Popular Name: (4R,4aS,5S,5aR,12aS)-4-dimethylamino-3,5,10,12,12a-pentahydroxy-6-methylene-1,11-dioxo-4,4a,5,5a-tet (4R,4aS,5S,5aR,12aS)-4-dimethyla…

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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) -1.02 1.14 -98.29 6 10 -1 188 441.416 2 ↓
Hi High (pH 8-9.5) -1.02 2.14 -182.93 5 10 -2 191 440.408 2 ↓
Mid Mid (pH 6-8) -1.02 -1.78 -64.67 8 10 1 183 443.432 2 ↓

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