In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 18 | Yes |
Popular Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-ethyl-piperidine-4-carboxamide 1-[(4-bromopyrazol-1-yl)methyl]-…
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) | 1.40 | 3.73 | -12.4 | 1 | 5 | 0 | 50 | 315.215 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.40 | 6.06 | -50.76 | 2 | 5 | 1 | 51 | 316.223 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.