In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | No |
Popular Name: (2S)-2-amino-N-[(3R)-1,1-dioxothiolan-3-yl]-N-prop-2-ynyl-propanamide (2S)-2-amino-N-[(3R)-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) | -1.45 | -0.58 | -56.38 | 3 | 5 | 1 | 82 | 245.324 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.45 | -0.9 | -15.3 | 2 | 5 | 0 | 80 | 244.316 | 3 | ↓ |