| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2008 | 22 | Yes |
Popular Name: (1S)-1-(3-methoxyphenyl)-N,N-dimethyl-N'-[(1S)-1-(2-pyridyl)ethyl]ethane-1,2-diamine (1S)-1-(3-methoxyphenyl)-N,N-dim…
| 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) | 2.53 | 8.64 | -33.45 | 2 | 4 | 1 | 39 | 300.426 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 6.32 | -5.03 | 1 | 4 | 0 | 37 | 299.418 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 6.27 | -33.54 | 2 | 4 | 1 | 42 | 300.426 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.53 | 9.29 | -94.63 | 3 | 4 | 2 | 40 | 301.434 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.53 | 8.35 | -110.94 | 3 | 4 | 2 | 43 | 301.434 | 7 | ↓ |
