In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 26 | 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) | 3.15 | 4.45 | -40.73 | 0 | 5 | -1 | 73 | 383.836 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.96 | 6.96 | -8.99 | 1 | 5 | 0 | 66 | 384.844 | 2 | ↓ |