| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 19 | Yes |
Popular Name: 2-[4-[(2R,3S)-2-amino-3-methyl-pentanoyl]-1,4-diazepan-1-yl]acetamide 2-[4-[(2R,3S)-2-amino-3-methyl-p…
| 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) | -0.95 | 1.55 | -99.79 | 6 | 6 | 2 | 95 | 272.393 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.95 | -0.06 | -48.02 | 5 | 6 | 1 | 94 | 271.385 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.95 | 1.21 | -39.74 | 5 | 6 | 1 | 94 | 271.385 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.95 | -0.39 | -11.22 | 4 | 6 | 0 | 93 | 270.377 | 5 | ↓ |
