In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 14 | Yes |
Popular Name: (3R)-3-(4-hydroxypyrimidin-2-yl)sulfanylpentanenitrile (3R)-3-(4-hydroxypyrimidin-2-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) | 1.26 | 4.5 | -14.38 | 1 | 4 | 0 | 70 | 209.274 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.72 | 2.69 | -49.25 | 0 | 4 | -1 | 73 | 208.266 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 4.11 | -23.53 | 1 | 4 | 0 | 70 | 209.274 | 4 | ↓ |