In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: [4-(2-hydroxyethyl)piperazin-1-yl]-(4-pyrrol-1-ylphenyl)methanone [4-(2-hydroxyethyl)piperazin-1-y…
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) | 0.42 | 4.02 | -12.05 | 1 | 5 | 0 | 49 | 299.374 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.42 | 6.39 | -47.64 | 2 | 5 | 1 | 50 | 300.382 | 4 | ↓ |