| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(5-bromo-2-methoxy-phenyl)-N-isobutyl-N-isopropyl-ethane-1,2-diamine (1S)-1-(5-bromo-2-methoxy-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) | 3.32 | 7.08 | -114.09 | 4 | 3 | 2 | 41 | 345.325 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 6.84 | -27.39 | 3 | 3 | 1 | 40 | 344.317 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.32 | 6.04 | -42.52 | 3 | 3 | 1 | 40 | 344.317 | 7 | ↓ |
