| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 21 | Yes |
Popular Name: 4-methyl-3-[[(4S)-1-methyl-4,5,6,7-tetrahydroindazol-4-yl]amino]benzoic 4-methyl-3-[[(4S)-1-methyl-4,5,6…
| 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) | 2.86 | 7.56 | -63.09 | 1 | 5 | -1 | 70 | 284.339 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.86 | 7.95 | -70.01 | 2 | 5 | 0 | 71 | 285.347 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
