In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2010 | 33 | 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) | 4.20 | 10.55 | -12.42 | 2 | 7 | 0 | 83 | 477.512 | 9 | ↓ |
Hi High (pH 8-9.5) | 4.20 | 10.35 | -45.33 | 1 | 7 | -1 | 81 | 476.504 | 9 | ↓ |