In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 27 | 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) | 1.70 | 9.06 | -48.25 | 2 | 6 | 1 | 63 | 368.505 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 9.5 | -89.55 | 3 | 6 | 2 | 64 | 369.513 | 7 | ↓ |