In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2010 | 20 | Yes |
Popular Name: 5-(2,3,4,5,6-pentamethylphenyl)pyridine-3-carboxylic 5-(2,3,4,5,6-pentamethylphenyl)p…
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) | 4.17 | 9.42 | -47.25 | 0 | 3 | -1 | 53 | 268.336 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.17 | 9.86 | -41.63 | 1 | 3 | 0 | 54 | 269.344 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.