In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 15 | Yes |
Popular Name: (2S)-N-[(3S)-1-methylpyrrolidin-3-yl]morpholine-2-carboxamide (2S)-N-[(3S)-1-methylpyrrolidin-…
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) | -1.16 | 2.06 | -103.41 | 4 | 5 | 2 | 59 | 215.297 | 2 | ↓ |
Hi High (pH 8-9.5) | -1.16 | 0.72 | -44.87 | 3 | 5 | 1 | 55 | 214.289 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.98 | -1.34 | -66.2 | 3 | 5 | 1 | 66 | 214.289 | 2 | ↓ |