In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 20 | Yes |
Popular Name: 2-[3-[(5-bromo-2-propoxy-phenyl)methylamino]propylamino]ethanol 2-[3-[(5-bromo-2-propoxy-phenyl)…
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) | 2.24 | 4.57 | -106.23 | 5 | 4 | 2 | 63 | 347.297 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 3.08 | -41.68 | 4 | 4 | 1 | 58 | 346.289 | 11 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 3.14 | -37.84 | 4 | 4 | 1 | 58 | 346.289 | 11 | ↓ |