| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: (3S)-1-[(1-cyanoindolizin-2-yl)methyl]-3-methyl-pyrrolidine-3-carboxylic (3S)-1-[(1-cyanoindolizin-2-yl)m…
| 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) | 1.44 | 10.73 | -59.62 | 1 | 5 | 0 | 73 | 283.331 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.44 | 8.27 | -63.27 | 0 | 5 | -1 | 72 | 282.323 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
