| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2010 | 16 | Yes |
Popular Name: (1S)-N-(2,2-dimethylpropyl)-N-methyl-1-(3-pyridyl)ethane-1,2-diamine (1S)-N-(2,2-dimethylpropyl)-N-me…
| 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) | 1.20 | 2.65 | -47.66 | 3 | 3 | 1 | 44 | 222.356 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.20 | 2.29 | -3.01 | 2 | 3 | 0 | 42 | 221.348 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.20 | 4.64 | -127.91 | 4 | 3 | 2 | 45 | 223.364 | 5 | ↓ |
