In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 18 | No |
Popular Name: (1R)-N'-[(3R)-1,1-dioxothiolan-3-yl]-N'-methyl-1-phenyl-ethane-1,2-diamine (1R)-N'-[(3R)-1,1-dioxothiolan-3…
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) | -1.02 | 1.03 | -57.09 | 3 | 4 | 1 | 65 | 269.39 | 4 | ↓ |
Hi High (pH 8-9.5) | -1.02 | 0.64 | -11.72 | 2 | 4 | 0 | 63 | 268.382 | 4 | ↓ |
Lo Low (pH 4.5-6) | -1.02 | 3.01 | -145.56 | 4 | 4 | 2 | 66 | 270.398 | 4 | ↓ |