In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 17 | Yes |
Popular Name: (4S)-4-(1-allylpyrazol-4-yl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine (4S)-4-(1-allylpyrazol-4-yl)-4,5…
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) | 0.80 | 4.99 | -44.8 | 3 | 5 | 1 | 63 | 230.295 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.80 | 3.68 | -9.91 | 2 | 5 | 0 | 59 | 229.287 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.