| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2011 | 22 | Yes |
Popular Name: (3R,5R)-N-[(3-methyl-1H-pyrazol-4-yl)methyl]-3,5-bis(trifluoromethyl)cyclohexanamine (3R,5R)-N-[(3-methyl-1H-pyrazol-…
None
| 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) | 3.28 | 6.2 | -49.34 | 3 | 3 | 1 | 45 | 330.296 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.28 | 5.03 | -7.47 | 2 | 3 | 0 | 41 | 329.288 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
