| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 21 | Yes |
Popular Name: (2S,4R)-4-amino-N-ethyl-1-(4-isopropylthiazole-2-carbonyl)pyrrolidine-2-carboxamide (2S,4R)-4-amino-N-ethyl-1-(4-iso…
| 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) | -0.22 | 0.87 | -76.51 | 4 | 6 | 1 | 90 | 311.431 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.22 | 0.57 | -20.47 | 3 | 6 | 0 | 88 | 310.423 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
