In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 21 | No |
Popular Name: (2S)-4-hydroxy-1-methyl-3-(5-methylfuran-2-carbonyl)-2-(2-thienyl)-2H-pyrrol-5-one (2S)-4-hydroxy-1-methyl-3-(5-met…
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) | 1.76 | 5.37 | -58.19 | 0 | 5 | -1 | 74 | 302.331 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 4.62 | -12.15 | 1 | 5 | 0 | 71 | 303.339 | 3 | ↓ |