In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: 1,3-dimethyl-5-[(3-pyrrolidin-1-ylpropylamino)methyl]pyrimidine-2,4-dione 1,3-dimethyl-5-[(3-pyrrolidin-1-…
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) | -0.35 | 5.2 | -47.28 | 2 | 6 | 1 | 60 | 281.38 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.35 | 6.62 | -118.73 | 3 | 6 | 2 | 65 | 282.388 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.35 | 4.1 | -53.57 | 2 | 6 | 1 | 64 | 281.38 | 6 | ↓ |