In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2011 | 14 | Yes |
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) | 3.71 | 5.41 | -4.27 | 1 | 2 | 0 | 21 | 191.274 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.71 | 5.83 | -32.03 | 2 | 2 | 1 | 26 | 192.282 | 2 | ↓ |