In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2011 | 19 | Yes |
Popular Name: 6-[4-(2-aminoethyl)piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione 6-[4-(2-aminoethyl)piperidine-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) | -0.51 | -1.32 | -64.96 | 4 | 7 | 0 | 117 | 266.301 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.97 | -0.71 | -55.88 | 5 | 7 | 1 | 114 | 267.309 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.