In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2005 | 29 | 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) | 1.62 | 7.99 | -25.96 | 2 | 8 | 0 | 97 | 391.41 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.62 | 8.45 | -60.35 | 3 | 8 | 1 | 98 | 392.418 | 7 | ↓ |