| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 19 | Yes |
Popular Name: 3-(Pyridin-4-ylsulfanyl)-pyrrolidine-1-carboxylic acid tert-butyl ester 3-(Pyridin-4-ylsulfanyl)-pyrroli…
(R)-3-(Pyridin-4-ylsulfanyl)-pyrrolidine-1-carboxylicacidtert-butylester
(S)-3-(Pyridin-4-ylsulfanyl)-pyrrolidine-1-carboxylic acid tert-butyl ester
| 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) | 2.27 | 6.85 | -8.41 | 0 | 4 | 0 | 42 | 280.393 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 7.32 | -35.91 | 1 | 4 | 1 | 44 | 281.401 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
