In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 28 | Yes |
Popular Name: [(3R)-3-isobutyl-1-[(3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)methyl]-3-piperidyl]methanol [(3R)-3-isobutyl-1-[(3-phenylpyr…
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) | 3.57 | 10.73 | -54.45 | 2 | 5 | 1 | 55 | 379.528 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.57 | 8.5 | -9.32 | 1 | 5 | 0 | 54 | 378.52 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.