In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 19 | No |
Popular Name: (2S)-2-amino-N-[(3S)-1,1-dioxothiolan-3-yl]-2-methyl-N-prop-2-ynyl-pentanamide (2S)-2-amino-N-[(3S)-1,1-dioxoth…
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) | 0.63 | 1.18 | -55.33 | 3 | 5 | 1 | 82 | 287.405 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.63 | 1.59 | -17.26 | 2 | 5 | 0 | 80 | 286.397 | 5 | ↓ |