In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 21 | Yes |
Popular Name: 6-methyl-2-[(3S)-3-(1,2,4-triazol-1-ylmethyl)-1-piperidyl]imidazo[2,1-b][1,3,4]thiadiazole 6-methyl-2-[(3S)-3-(1,2,4-triazo…
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) | 1.07 | 10.08 | -19.01 | 0 | 7 | 0 | 64 | 303.395 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 10.53 | -32.02 | 1 | 7 | 1 | 65 | 304.403 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.