In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2008 | 20 | Yes |
Popular Name: N-methyl-N-[(1-methylpyrrol-2-yl)methyl]-4-(4-pyridyl)butanamide N-methyl-N-[(1-methylpyrrol-2-yl…
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) | 1.59 | 8.62 | -10.5 | 0 | 4 | 0 | 38 | 271.364 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 8.9 | -36.52 | 1 | 4 | 1 | 39 | 272.372 | 6 | ↓ |