In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 23 | No |
Popular Name: (2S)-4-hydroxy-1-methyl-2-(2-thienyl)-3-(1,3,5-trimethylpyrazole-4-carbonyl)-2H-pyrrol-5-one (2S)-4-hydroxy-1-methyl-2-(2-thi…
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) | 1.10 | 4.9 | -53.28 | 0 | 6 | -1 | 78 | 330.389 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 4.14 | -12.11 | 1 | 6 | 0 | 75 | 331.397 | 3 | ↓ |