In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2010 | 27 | No |
Popular Name: N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2-[(oxoBLAHyl)methylsulfanyl]acetamide N-[[(2S)-1-ethylpyrrolidin-2-yl]…
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) | 1.90 | 7.99 | -52.69 | 3 | 6 | 1 | 79 | 407.585 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.36 | 5.54 | -78.92 | 2 | 6 | 0 | 82 | 406.577 | 7 | ↓ |