In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2011 | 21 | Yes |
Popular Name: 1-[5-[(isopropylamino)methyl]imidazo[2,1-b]thiazol-6-yl]pyrazole-4-carboxamide 1-[5-[(isopropylamino)methyl]imi…
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) | 0.52 | 4.53 | -49.58 | 4 | 7 | 1 | 95 | 305.387 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 3.33 | -16.01 | 3 | 7 | 0 | 90 | 304.379 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.