| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2011 | 20 | Yes |
Popular Name: (3S)-1-(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)-3-methyl-pyrrolidine-3-carboxylic (3S)-1-(3-cyano-6,7-dihydro-5H-c…
| 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) | 1.72 | 8.35 | -53.29 | 0 | 5 | -1 | 80 | 270.312 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 9.28 | -42.93 | 1 | 5 | 0 | 81 | 271.32 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
