In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 24 | Yes |
Popular Name: N-ethyl-N-[(3S)-1-[(1S)-1-phenylethyl]pyrrolidin-3-yl]pyrazine-2-carboxamide N-ethyl-N-[(3S)-1-[(1S)-1-phenyl…
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) | 2.39 | 9.7 | -35.31 | 1 | 5 | 1 | 51 | 325.436 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 7.6 | -9.82 | 0 | 5 | 0 | 49 | 324.428 | 5 | ↓ |