In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 15 | No |
Popular Name: (E)-3-[1-[(2R)-2,3-dihydroxypropyl]pyrrol-2-yl]prop-2-enoic (E)-3-[1-[(2R)-2,3-dihydroxyprop…
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) | -0.32 | 0.03 | -57.45 | 2 | 5 | -1 | 86 | 210.209 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.32 | -1.06 | -13.16 | 3 | 5 | 0 | 83 | 211.217 | 5 | ↓ |