In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 20th, 2009 | 34 | 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) | 1.84 | 9.21 | -65.86 | 2 | 9 | 0 | 112 | 464.522 | 8 | ↓ |
Lo Low (pH 4.5-6) | 1.84 | 8.08 | -57.32 | 3 | 9 | 1 | 109 | 465.53 | 8 | ↓ |