In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 20 | Yes |
Popular Name: (2R)-2-(2,2-dimethylpyrrolidin-1-yl)-2-(6-quinolyl)ethanamine (2R)-2-(2,2-dimethylpyrrolidin-1…
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) | 1.92 | 5.11 | -47.66 | 3 | 3 | 1 | 44 | 270.4 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 5.78 | -134.94 | 4 | 3 | 2 | 45 | 271.408 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.