In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2011 | 21 | Yes |
Popular Name: 3-(3,4-dichlorophenyl)-N-[2-(2-pyridyl)ethyl]propanamide 3-(3,4-dichlorophenyl)-N-[2-(2-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) | 3.66 | 8.07 | -12.14 | 1 | 3 | 0 | 42 | 323.223 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.66 | 8.42 | -39.57 | 2 | 3 | 1 | 43 | 324.231 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.