In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 15 | No |
Popular Name: 2-chloro-1-[(2R)-2-(3-pyridyl)pyrrolidin-1-yl]ethanone 2-chloro-1-[(2R)-2-(3-pyridyl)py…
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) | 1.02 | 5.84 | -12.18 | 0 | 3 | 0 | 33 | 224.691 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.02 | 6.3 | -35.95 | 1 | 3 | 1 | 34 | 225.699 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.