In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 20 | Yes |
Popular Name: (4-bromo-1-isopropyl-pyrrol-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone (4-bromo-1-isopropyl-pyrrol-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) | 1.33 | 2.87 | -8.06 | 1 | 5 | 0 | 49 | 344.253 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.33 | 5.16 | -39.98 | 2 | 5 | 1 | 50 | 345.261 | 4 | ↓ |