In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 3rd, 2011 | 25 | No |
Popular Name: (5Z)-2-(cyclohexylamino)-5-[(1,3-dimethylpyrazolo[3,4-b]pyridin-5-yl)methylene]thiazol-4-one (5Z)-2-(cyclohexylamino)-5-[(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) | 2.98 | 7 | -17.18 | 1 | 6 | 0 | 73 | 355.467 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 6.34 | -41.94 | 0 | 6 | -1 | 75 | 354.459 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.