UCSF

ZINC12220893

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 5th, 2008 30 Yes

Popular Name: N-[(1R)-1-(2-methoxyphenyl)ethyl]-3-[2-(4-pyridyl)pyrrolo[2,3-b]pyridin-1-yl]propanamide N-[(1R)-1-(2-methoxyphenyl)ethyl…

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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) 3.06 -0.58 -14.5 1 6 0 69 400.482 7 ↓
Lo Low (pH 4.5-6) 3.06 -0.48 -42.11 2 6 1 70 401.49 7 ↓
Lo Low (pH 4.5-6) 3.06 -0.47 -46.4 2 6 1 70 401.49 7 ↓
Lo Low (pH 4.5-6) 3.06 -0.37 -87.92 3 6 2 72 402.498 7 ↓

Activity (Go SEA)

Rings

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