In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 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) | 2.48 | 5.19 | -5.76 | 1 | 2 | 0 | 36 | 192.237 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.48 | 6.47 | -51.48 | 2 | 2 | 1 | 40 | 193.245 | 4 | ↓ |