In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 20 | Yes |
Popular Name: 6-methyl-2-[(2R)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]imidazo[2,1-b][1,3,4]thiadiazole 6-methyl-2-[(2R)-2-(pyrazol-1-yl…
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) | 1.61 | 7.88 | -10.58 | 0 | 6 | 0 | 51 | 288.38 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.61 | 8.94 | -26.43 | 1 | 6 | 1 | 53 | 289.388 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.