In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 14th, 2009 | 34 | Yes |
Popular Name: 1-[6-(1,4,8,11-tetrazacyclotetradec-1-yl)hexyl]-1,4,8,11-tetrazacyclotetradecane 1-[6-(1,4,8,11-tetrazacyclotetra…
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) | -0.66 | 2.48 | -407.99 | 11 | 8 | 5 | 98 | 487.846 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.66 | 0.19 | -268.52 | 10 | 8 | 4 | 97 | 486.838 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.66 | 0.08 | -166.93 | 9 | 8 | 3 | 89 | 485.83 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.66 | 2.46 | -294.85 | 10 | 8 | 4 | 90 | 486.838 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.66 | 1.36 | -263.87 | 10 | 8 | 4 | 94 | 486.838 | 7 | ↓ |
Lo Low (pH 4.5-6) | -0.66 | 3.85 | -419.45 | 11 | 8 | 5 | 95 | 487.846 | 7 | ↓ |