| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 14th, 2010 | 12 | Yes |
Popular Name: 4-[[(2S)-3-amino-2-methyl-propyl]-methyl-amino]butan-1-ol 4-[[(2S)-3-amino-2-methyl-propyl…
| 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) | -0.20 | 1.17 | -103.19 | 5 | 3 | 2 | 52 | 176.304 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.20 | 0.8 | -35.59 | 4 | 3 | 1 | 51 | 175.296 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.20 | -0.87 | -43.28 | 4 | 3 | 1 | 51 | 175.296 | 7 | ↓ |
