In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 20 | Yes |
Popular Name: (2S)-1-[2-[(5-bromo-2-propoxy-phenyl)methylamino]ethylamino]propan-2-ol (2S)-1-[2-[(5-bromo-2-propoxy-ph…
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) | 2.33 | 3.08 | -40.46 | 4 | 4 | 1 | 58 | 346.289 | 10 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 4.57 | -116.61 | 5 | 4 | 2 | 63 | 347.297 | 10 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 3.16 | -37.74 | 4 | 4 | 1 | 58 | 346.289 | 10 | ↓ |