In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2011 | 15 | Yes |
Popular Name: (2R)-3-[(5-chloro-2-pyridyl)sulfanyl]-1,1,1-trifluoro-propan-2-ol (2R)-3-[(5-chloro-2-pyridyl)sulf…
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) | 2.76 | 3.19 | -4.52 | 1 | 2 | 0 | 33 | 257.664 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.76 | 3.7 | -39.66 | 0 | 2 | -1 | 36 | 256.656 | 4 | ↓ |