| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 26 | Yes |
Popular Name: (2S,4R)-1-benzyl-N-methyl-4-[(4-methylsulfanylphenyl)methylamino]pyrrolidine-2-carboxamide (2S,4R)-1-benzyl-N-methyl-4-[(4-…
| 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) | 2.57 | 8.6 | -40.85 | 3 | 4 | 1 | 46 | 370.542 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.57 | 9.8 | -134.74 | 4 | 4 | 2 | 50 | 371.55 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
