In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 17 | Yes |
Popular Name: (2R,4R)-4-hydroxy-N-(3-methylsulfanylphenyl)pyrrolidine-2-carboxamide (2R,4R)-4-hydroxy-N-(3-methylsul…
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) | 0.79 | 1.3 | -47.23 | 4 | 4 | 1 | 66 | 253.347 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.79 | -0.06 | -11.31 | 3 | 4 | 0 | 61 | 252.339 | 3 | ↓ |