| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 20 | Yes |
Popular Name: (2S)-1-[5-(3-aminoprop-1-ynyl)pyridine-3-carbonyl]pyrrolidine-2-carboxamide (2S)-1-[5-(3-aminoprop-1-ynyl)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) | -1.66 | 0.34 | -67.81 | 5 | 6 | 1 | 104 | 273.316 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.66 | -0.06 | -18.22 | 4 | 6 | 0 | 102 | 272.308 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
