In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 20 | Yes |
Popular Name: 2-[1-[2-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]-2-oxo-ethyl]cyclopentyl]acetic 2-[1-[2-[(3R)-3-(dimethylamino)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) | 1.08 | 8.3 | -66.94 | 1 | 5 | 0 | 65 | 282.384 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 5.9 | -49.03 | 0 | 5 | -1 | 64 | 281.376 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | 6.31 | -40.52 | 2 | 5 | 1 | 62 | 283.392 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.