| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 19 | No |
Popular Name: (1S,2R,7R,8R)-1,2,7,8-tetramethyl-3,6,9,12,15-pentazacyclopentadecane (1S,2R,7R,8R)-1,2,7,8-tetramethy…
| 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) | 0.07 | 0.94 | -97.26 | 7 | 5 | 2 | 69 | 273.469 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.07 | -2.64 | -0.72 | 5 | 5 | 0 | 60 | 271.453 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.07 | -0.82 | -29.08 | 6 | 5 | 1 | 65 | 272.461 | 0 | ↓ |
| Hi High (pH 8-9.5) | 0.07 | -1.9 | -32.08 | 6 | 5 | 1 | 65 | 272.461 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 0.43 | -84.25 | 7 | 5 | 2 | 69 | 273.469 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | 1.08 | -181.87 | 8 | 5 | 3 | 74 | 274.477 | 0 | ↓ |
| Mid Mid (pH 6-8) | 0.07 | -0.47 | -83.22 | 7 | 5 | 2 | 69 | 273.469 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.07 | 1.28 | -198.99 | 8 | 5 | 3 | 74 | 274.477 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.07 | 1.61 | -189.3 | 8 | 5 | 3 | 74 | 274.477 | 0 | ↓ |
