In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 17 | Yes |
Popular Name: 6-[4-(2-aminoethyl)-1-piperidyl]-2H-1,2,4-triazine-3,5-dione 6-[4-(2-aminoethyl)-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) | -0.96 | -0.61 | -49.99 | 5 | 7 | 1 | 109 | 240.287 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.50 | -2.3 | -70.72 | 4 | 7 | 0 | 113 | 239.279 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.