In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 19 | Yes |
Popular Name: 1-(2,4-dichlorophenyl)-2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]ethanone 1-(2,4-dichlorophenyl)-2-[(3R)-3…
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) | 2.92 | 7.35 | -44.09 | 1 | 3 | 1 | 25 | 302.225 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 4.95 | -7.44 | 0 | 3 | 0 | 24 | 301.217 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.