In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 21 | Yes |
Popular Name: 2,4-dimethyl-5-[(1R)-1-[[(1S)-1-(2-thienyl)butyl]amino]ethyl]-1H-pyrimidin-6-one 2,4-dimethyl-5-[(1R)-1-[[(1S)-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) | 2.95 | 7.37 | -28.02 | 3 | 4 | 1 | 62 | 306.455 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.95 | 6.57 | -9.1 | 2 | 4 | 0 | 58 | 305.447 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.