| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 23 | Yes |
Popular Name: 3-(azocan-1-yl)-N-[(1R)-2-(3,5-dimethylpyrazol-1-yl)-1-methyl-ethyl]propanamide 3-(azocan-1-yl)-N-[(1R)-2-(3,5-d…
| 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) | 2.48 | 8.73 | -45.26 | 2 | 5 | 1 | 51 | 321.489 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.48 | 9.01 | -85.51 | 3 | 5 | 2 | 53 | 322.497 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
