In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 20 | Yes |
Popular Name: (2S,3S)-2-amino-3-methyl-1-(4-pyrazin-2-ylpiperazin-1-yl)pentan-1-one (2S,3S)-2-amino-3-methyl-1-(4-py…
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) | 0.16 | 3.25 | -50.11 | 3 | 6 | 1 | 77 | 278.38 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.16 | 2.92 | -11.21 | 2 | 6 | 0 | 75 | 277.372 | 4 | ↓ |