In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 25 | Yes |
Popular Name: 2-[4-[ethyl-[2-(4-pyridyl)ethyl]amino]-2-quinolyl]acetic 2-[4-[ethyl-[2-(4-pyridyl)ethyl]…
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) | 3.05 | 11.26 | -37.57 | 1 | 5 | 0 | 70 | 335.407 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 11.72 | -66.83 | 2 | 5 | 1 | 72 | 336.415 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.