| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 19 | Yes |
Popular Name: (2R)-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-1-(4-fluorophenyl)propan-2-amine (2R)-N-[(3,5-dimethyl-1H-pyrazol…
| 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) | 2.55 | 7.17 | -44.42 | 3 | 3 | 1 | 45 | 262.352 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 5.98 | -6.14 | 2 | 3 | 0 | 41 | 261.344 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
