In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2010 | 18 | Yes |
Popular Name: [1-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]pyrazol-4-yl]methanol [1-[(4-methoxy-3,5-dimethyl-2-py…
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) | 1.28 | 2.17 | -12.55 | 1 | 5 | 0 | 60 | 247.298 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.28 | 2.72 | -36.08 | 2 | 5 | 1 | 61 | 248.306 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.