In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 37 | No |
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) | 3.88 | 11.99 | -71.64 | 1 | 8 | 0 | 93 | 508.615 | 13 | ↓ |
Lo Low (pH 4.5-6) | 3.88 | 11.24 | -54.59 | 2 | 8 | 1 | 90 | 509.623 | 13 | ↓ |