| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 21 | Yes |
Popular Name: 2-[4-[(3R)-3-propylpyrrolidine-3-carbonyl]-1,4-diazepan-1-yl]acetic 2-[4-[(3R)-3-propylpyrrolidine-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) | -0.42 | 6.87 | -78.05 | 3 | 6 | 1 | 81 | 298.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.42 | 5.26 | -79.27 | 2 | 6 | 0 | 80 | 297.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
