| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 16 | Yes |
Popular Name: (1S)-1-[3,5-dimethyl-1-[[(3R)-tetrahydrofuran-3-yl]methyl]pyrazol-4-yl]ethanamine (1S)-1-[3,5-dimethyl-1-[[(3R)-te…
| 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) | -0.89 | 2.67 | -46.33 | 3 | 4 | 1 | 55 | 224.328 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.89 | 2.65 | -7.04 | 2 | 4 | 0 | 53 | 223.32 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
