| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2005 | 16 | Yes |
Popular Name: 4-bromo-N-(4-pyridinylmethyl)-1H-pyrrole-2-carboxamide 4-bromo-N-(4-pyridinylmethyl)-1H…
Find On: PubMed — Wikipedia — Google
CAS Number: 900019-47-8
| 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) | 1.13 | -3.09 | -10.64 | 2 | 4 | 0 | 57 | 280.125 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.13 | -2.98 | -45.11 | 3 | 4 | 1 | 59 | 281.133 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 192 - 195 | KeyOrganics |
