In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2008 | 21 | Yes |
Popular Name: 3-[2-(6-methyl-3-pyridyl)pyrrolo[2,3-b]pyridin-1-yl]propanoic 3-[2-(6-methyl-3-pyridyl)pyrrolo…
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) | 1.50 | 0.04 | -52.34 | 0 | 5 | -1 | 71 | 280.307 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 0.1 | -65.53 | 1 | 5 | 0 | 72 | 281.315 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 0.15 | -53.8 | 1 | 5 | 0 | 72 | 281.315 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.50 | 0.21 | -82.04 | 2 | 5 | 1 | 73 | 282.323 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.