In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 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) | 2.01 | 3.77 | -5.34 | 0 | 3 | 0 | 60 | 185.23 | 1 | ↓ |
Lo Low (pH 4.5-6) | 2.01 | 3.96 | -43.21 | 1 | 3 | 1 | 62 | 186.238 | 1 | ↓ |