| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 22 | Yes |
Popular Name: (2S,4R)-4-amino-1-[2-(benzotriazol-2-yl)acetyl]-N-methyl-pyrrolidine-2-carboxamide (2S,4R)-4-amino-1-[2-(benzotriaz…
| 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) | -0.93 | 0.14 | -77.24 | 4 | 8 | 1 | 108 | 303.346 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | -0.15 | -23.77 | 3 | 8 | 0 | 106 | 302.338 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
