In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | No |
Popular Name: 2-[[(3R)-1,1-dioxothiolan-3-yl]-methyl-amino]-6-methyl-pyridine-3-carbothioamide 2-[[(3R)-1,1-dioxothiolan-3-yl]-…
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) | 0.47 | 2.61 | -17.63 | 2 | 5 | 0 | 76 | 299.421 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.47 | 3.03 | -51.16 | 3 | 5 | 1 | 78 | 300.429 | 3 | ↓ |