| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2011 | 22 | Yes |
Popular Name: (3S,11R)-1,1,3,9,9,11-hexamethyl-4,8,12,16-tetrazacyclohexadecane (3S,11R)-1,1,3,9,9,11-hexamethyl…
| 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) | 2.68 | 5.8 | -342.21 | 8 | 4 | 4 | 66 | 316.578 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 2.47 | -95.53 | 6 | 4 | 2 | 57 | 314.562 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.68 | 2.88 | -88.07 | 6 | 4 | 2 | 57 | 314.562 | 0 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 4.6 | -201.86 | 7 | 4 | 3 | 62 | 315.57 | 0 | ↓ |
