In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 24 | No |
Popular Name: (2S)-3-acetyl-4-hydroxy-2-(5-methyl-2-furyl)-1-[2-(1-piperidyl)ethyl]-2H-pyrrol-5-one (2S)-3-acetyl-4-hydroxy-2-(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) | 1.19 | 8.16 | -66.97 | 1 | 6 | 0 | 78 | 332.4 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.19 | 7.21 | -45.15 | 2 | 6 | 1 | 75 | 333.408 | 5 | ↓ |