In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 26 | No |
Popular Name: (5S)-3-hydroxy-1-(2-hydroxyethyl)-5-phenyl-4-[(E)-3-phenylacryloyl]-3-pyrrolin-2-one (5S)-3-hydroxy-1-(2-hydroxyethyl…
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) | 2.12 | -1.56 | -16.37 | 2 | 5 | 0 | 77 | 349.386 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.12 | -1.86 | -31.31 | 2 | 5 | 0 | 77 | 349.386 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.53 | -1.75 | -25.51 | 1 | 5 | 0 | 74 | 349.386 | 6 | ↓ |