| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2011 | 18 | Yes |
Popular Name: (2S,4S)-4-hydroxy-N-[(4R)-4,5,6,7-tetrahydrobenzothiophen-4-yl]pyrrolidine-2-carboxamide (2S,4S)-4-hydroxy-N-[(4R)-4,5,6,…
| 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) | -0.23 | 1.38 | -41.76 | 4 | 4 | 1 | 66 | 267.374 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.23 | 0.19 | -12.94 | 3 | 4 | 0 | 61 | 266.366 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
