In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 21 | Yes |
Popular Name: 5-[[(2R)-2-[2-(methylamino)ethyl]-1-piperidyl]sulfonyl]-1H-pyrimidine-2,4-dione 5-[[(2R)-2-[2-(methylamino)ethyl…
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) | -0.03 | -2.3 | -57.84 | 3 | 8 | 0 | 123 | 316.383 | 5 | ↓ |
Mid Mid (pH 6-8) | -0.49 | -0.35 | -63.8 | 4 | 8 | 1 | 120 | 317.391 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.