In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 4th, 2009 | 18 | Yes |
Popular Name: 4-bromo-1-methyl-N-[(1R)-1-(4-pyridyl)ethyl]pyrrole-2-carboxamide 4-bromo-1-methyl-N-[(1R)-1-(4-py…
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) | 1.76 | 5.77 | -8.33 | 1 | 4 | 0 | 47 | 308.179 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 6.23 | -40.64 | 2 | 4 | 1 | 48 | 309.187 | 3 | ↓ |