In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 19 | Yes |
Popular Name: 6-[3-[(2S)-2-methyl-1-piperidyl]propylamino]-2H-1,2,4-triazine-3,5-dione 6-[3-[(2S)-2-methyl-1-piperidyl]…
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) | 0.31 | 2.49 | -41.17 | 4 | 7 | 1 | 95 | 268.341 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 0.83 | -52.97 | 3 | 7 | 0 | 98 | 267.333 | 5 | ↓ |