In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 21 | Yes |
Popular Name: (2R,4S)-4-hydroxy-N-[4-(methanesulfonamido)-3-methyl-phenyl]pyrrolidine-2-carboxamide (2R,4S)-4-hydroxy-N-[4-(methanes…
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) | -0.02 | -2.21 | -50.03 | 5 | 7 | 1 | 112 | 314.387 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.02 | -3.52 | -50.33 | 3 | 7 | -1 | 110 | 312.371 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.02 | -2.13 | -67.02 | 4 | 7 | 0 | 114 | 313.379 | 4 | ↓ |