| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2008 | 17 | Yes |
Popular Name: (2S)-N-[(1R)-1,3-dimethylbutyl]-3-ethyl-N',N'-dimethyl-pentane-1,2-diamine (2S)-N-[(1R)-1,3-dimethylbutyl]-…
| 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) | 4.22 | 7.03 | -33.96 | 2 | 2 | 1 | 20 | 243.459 | 9 | ↓ |
| Hi High (pH 8-9.5) | 4.22 | 9.04 | -32.71 | 2 | 2 | 1 | 16 | 243.459 | 9 | ↓ |
| Mid Mid (pH 6-8) | 4.22 | 9.15 | -118.39 | 3 | 2 | 2 | 21 | 244.467 | 9 | ↓ |
