| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2010 | 16 | Yes |
Popular Name: 1-[3,5-dimethyl-1-[[(3S)-tetrahydrofuran-3-yl]methyl]pyrazol-4-yl]-N-methyl-methanamine 1-[3,5-dimethyl-1-[[(3S)-tetrahy…
| 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 | 4.14 | -43.8 | 2 | 4 | 1 | 44 | 224.328 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 2.69 | -7.35 | 1 | 4 | 0 | 39 | 223.32 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
