In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 26th, 2010 | 18 | Yes |
Popular Name: 6-[[(1R)-1-methyl-2-(1-piperidyl)ethyl]amino]-2H-1,2,4-triazine-3,5-dione 6-[[(1R)-1-methyl-2-(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) | 0.04 | 2.3 | -41.82 | 4 | 7 | 1 | 95 | 254.314 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.49 | 0.64 | -49.47 | 3 | 7 | 0 | 98 | 253.306 | 4 | ↓ |