In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 24th, 2010 | 33 | 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) | 5.00 | 9.17 | -59.94 | 1 | 6 | -1 | 88 | 507.36 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.00 | 8.4 | -15.47 | 2 | 6 | 0 | 85 | 508.368 | 7 | ↓ |