In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2009 | 24 | Yes |
Popular Name: 2-[(6-imidazol-1-yl-3-pyridyl)methylamino]-7-methyl-[1,3,4]thiadiazolo[2,3-b]pyrimidin-5-one 2-[(6-imidazol-1-yl-3-pyridyl)me…
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) | 0.91 | 8.1 | -23.47 | 1 | 8 | 0 | 90 | 339.384 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 8.59 | -53.43 | 2 | 8 | 1 | 91 | 340.392 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.