| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 15 | Yes |
Popular Name: (2S)-N1-(2-dimethylaminoethyl)-N1-isobutyl-N2-methyl-propane-1,2-diamine (2S)-N1-(2-dimethylaminoethyl)-N…
| 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) | 1.61 | 5.11 | -109.03 | 3 | 3 | 2 | 24 | 217.401 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 3.61 | -32.52 | 2 | 3 | 1 | 23 | 216.393 | 8 | ↓ |
| Hi High (pH 8-9.5) | 1.61 | 5.1 | -34.33 | 2 | 3 | 1 | 20 | 216.393 | 8 | ↓ |
| Mid Mid (pH 6-8) | 1.61 | 6.22 | -89.77 | 3 | 3 | 2 | 24 | 217.401 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 1.61 | 7.58 | -210.34 | 4 | 3 | 3 | 25 | 218.409 | 8 | ↓ |
