In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2010 | 19 | Yes |
Popular Name: 5-chloro-N,1,3-trimethyl-N-(2-pyridylmethyl)pyrazole-4-carboxamide 5-chloro-N,1,3-trimethyl-N-(2-py…
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) | 0.53 | 5.51 | -14.04 | 0 | 5 | 0 | 51 | 278.743 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.53 | 5.94 | -37.75 | 1 | 5 | 1 | 52 | 279.751 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.