| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 16 | No |
Popular Name: (3R)-4-[4-(chloromethyl)-2,5-dimethyl-pyrazol-3-yl]-3-methyl-thiomorpholine (3R)-4-[4-(chloromethyl)-2,5-dim…
| 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) | 2.06 | 7.19 | -4.85 | 0 | 3 | 0 | 21 | 259.806 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 7.32 | -28.98 | 1 | 3 | 1 | 22 | 260.814 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
