| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 26 | Yes |
Popular Name: 1-[(3S)-6-(dimethylamino)-3-hydroxy-3-methyl-hex-4-ynyl]-3-methyl-7-propyl-purine-2,6-dione 1-[(3S)-6-(dimethylamino)-3-hydr…
| 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) | 1.64 | 9.15 | -43.69 | 2 | 8 | 1 | 87 | 362.454 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.64 | 6.65 | -12.98 | 1 | 8 | 0 | 85 | 361.446 | 6 | ↓ |
