| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 21st, 2009 | 19 | Yes |
Popular Name: (1S,2R,4R)-4-tert-butyl-2-(4-methyl-1,4-diazepan-1-yl)cyclohexanamine (1S,2R,4R)-4-tert-butyl-2-(4-met…
| 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) | 2.10 | 6.02 | -95.86 | 4 | 3 | 2 | 35 | 269.477 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.10 | 3.75 | -40.22 | 3 | 3 | 1 | 34 | 268.469 | 2 | ↓ |
