| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-N1-[(1S)-1,3-dimethylbutyl]-N1-methyl-1-(1-methylpyrazol-4-yl)butane-1,2-diamine (1S,2R)-N1-[(1S)-1,3-dimethylbut…
| 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) | 2.03 | 4.43 | -42.45 | 3 | 4 | 1 | 49 | 267.441 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 5.63 | -110.25 | 4 | 4 | 2 | 50 | 268.449 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.03 | 5.81 | -34.61 | 3 | 4 | 1 | 48 | 267.441 | 7 | ↓ |
