| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2010 | 17 | Yes |
Popular Name: (2S)-N2-(2-dimethylaminoethyl)-N1-ethyl-N2-isobutyl-butane-1,2-diamine (2S)-N2-(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) | 2.17 | 6.21 | -108.82 | 3 | 3 | 2 | 24 | 245.455 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 5.35 | -36.05 | 2 | 3 | 1 | 23 | 244.447 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 6.24 | -35.09 | 2 | 3 | 1 | 20 | 244.447 | 10 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 7.81 | -100.97 | 3 | 3 | 2 | 24 | 245.455 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 8.68 | -214.9 | 4 | 3 | 3 | 25 | 246.463 | 10 | ↓ |
