In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 21 | Yes |
Popular Name: 5-[[[(2S)-2-dimethylamino-4-methyl-pentyl]amino]methyl]-1,3-dimethyl-pyrimidine-2,4-dione 5-[[[(2S)-2-dimethylamino-4-meth…
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) | 0.61 | 5.2 | -53.49 | 2 | 6 | 1 | 64 | 297.423 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 6.09 | -43.48 | 2 | 6 | 1 | 60 | 297.423 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 7.23 | -127.59 | 3 | 6 | 2 | 65 | 298.431 | 7 | ↓ |