| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2009 | 21 | Yes |
Popular Name: (3R)-1-[4-(3-aminopropyl)-1,4-diazepan-1-yl]-3,5,5-trimethyl-hexan-1-one (3R)-1-[4-(3-aminopropyl)-1,4-di…
| 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) | 1.89 | 7.98 | -112.93 | 4 | 4 | 2 | 52 | 299.503 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.89 | 6.16 | -48.43 | 3 | 4 | 1 | 51 | 298.495 | 7 | ↓ |
