In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2011 | 21 | No |
Popular Name: N-[(3R)-1,1-dioxothiolan-3-yl]-2-[methyl(2-piperazin-1-ylethyl)amino]acetamide N-[(3R)-1,1-dioxothiolan-3-yl]-2…
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) | -1.20 | -0.72 | -110.76 | 4 | 7 | 2 | 88 | 320.459 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.20 | -2.06 | -54.34 | 3 | 7 | 1 | 83 | 319.451 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.20 | -2.98 | -53.95 | 3 | 7 | 1 | 86 | 319.451 | 6 | ↓ |