In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2009 | 32 | 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) | 3.85 | 7.93 | -15.86 | 1 | 7 | 0 | 71 | 443.588 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.85 | 9.92 | -52 | 2 | 7 | 1 | 72 | 444.596 | 8 | ↓ |