UCSF

ZINC12222778

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2008 28 Yes

Popular Name: 1-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-3-[2-(2-methyl-3-pyridyl)pyrrolo[2,3-b]pyridin-1-yl]propan-1- 1-[(2R,6R)-2,6-dimethylmorpholin…

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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) 2.35 -0.6 -11.12 0 6 0 60 378.476 4 ↓
Lo Low (pH 4.5-6) 2.35 -0.53 -43.47 1 6 1 62 379.484 4 ↓
Lo Low (pH 4.5-6) 2.35 -0.47 -39.78 1 6 1 62 379.484 4 ↓
Lo Low (pH 4.5-6) 2.35 -0.41 -87.01 2 6 2 63 380.492 4 ↓

Activity (Go SEA)

Rings

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