In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 19 | Yes |
Popular Name: 3-[[(6-methylimidazo[2,1-b][1,3,4]thiadiazol-2-yl)amino]methyl]benzonitrile 3-[[(6-methylimidazo[2,1-b][1,3,…
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) | 2.03 | 7.53 | -14.66 | 1 | 5 | 0 | 66 | 269.333 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 8.01 | -31.98 | 2 | 5 | 1 | 67 | 270.341 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.