In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 19 | Yes |
Popular Name: N-[(1-methylpyrrol-2-yl)methyl]-2-([1,2,4]triazolo[4,5-a]pyridin-3-yl)ethanamine N-[(1-methylpyrrol-2-yl)methyl]-…
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) | 1.46 | 7.39 | -14.89 | 1 | 5 | 0 | 47 | 255.325 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.46 | 8.85 | -59.65 | 2 | 5 | 1 | 52 | 256.333 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.