| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 19 | Yes |
Popular Name: (1S)-N-butyl-1-(4-isopropoxyphenyl)-N-methyl-ethane-1,2-diamine (1S)-N-butyl-1-(4-isopropoxyphen…
| 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) | 1.69 | 6.13 | -43.93 | 3 | 3 | 1 | 40 | 265.421 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 8.08 | -133.87 | 4 | 3 | 2 | 41 | 266.429 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 7.81 | -37.1 | 3 | 3 | 1 | 40 | 265.421 | 8 | ↓ |
