| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2008 | 17 | Yes |
Popular Name: (2S)-N',N',4-trimethyl-N-[(1R)-1-methylhexyl]pentane-1,2-diamine (2S)-N',N',4-trimethyl-N-[(1R)-1…
| 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) | 4.55 | 8.11 | -33.46 | 2 | 2 | 1 | 20 | 243.459 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.55 | 8.8 | -31.07 | 2 | 2 | 1 | 16 | 243.459 | 10 | ↓ |
| Mid Mid (pH 6-8) | 4.55 | 10.16 | -113.1 | 3 | 2 | 2 | 21 | 244.467 | 10 | ↓ |
