In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 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) | 6.05 | 12.23 | -11.35 | 1 | 6 | 0 | 71 | 467.635 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.38 | 13.01 | -36.1 | 2 | 6 | 1 | 70 | 468.643 | 10 | ↓ |