| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 18th, 2011 | 21 | Yes |
Popular Name: (3S)-3-methyl-1-[(3R)-1,2,3,4-tetrahydroisoquinoline-3-carbonyl]pyrrolidine-3-carboxylic (3S)-3-methyl-1-[(3R)-1,2,3,4-te…
| 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) | 0.82 | 5.62 | -51.01 | 1 | 5 | -1 | 72 | 287.339 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.82 | 6.95 | -55.83 | 2 | 5 | 0 | 77 | 288.347 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
