In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: 4-bromo-N-methyl-N-[2-[methyl-(1-methyl-4-piperidyl)amino]ethyl]-1H-pyrrole-2-carboxamide 4-bromo-N-methyl-N-[2-[methyl-(1…
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) | 1.72 | 6.11 | -43.25 | 2 | 5 | 1 | 44 | 358.304 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 8.57 | -104.69 | 3 | 5 | 2 | 45 | 359.312 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.72 | 6.19 | -44.08 | 2 | 5 | 1 | 44 | 358.304 | 5 | ↓ |