| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: [4-[(2R)-3-amino-2-methyl-propyl]-1,4-diazepan-1-yl]-(6-methyl-2-pyridyl)methanone [4-[(2R)-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) | -0.03 | 7.06 | -112.57 | 4 | 5 | 2 | 65 | 292.427 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.03 | 6.71 | -39.49 | 3 | 5 | 1 | 64 | 291.419 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.03 | 5.72 | -50.16 | 3 | 5 | 1 | 64 | 291.419 | 4 | ↓ |
