In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 25 | 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) | 3.32 | 5.74 | -16.69 | 0 | 5 | 0 | 67 | 380.535 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 6.84 | -40.17 | 1 | 5 | 1 | 68 | 381.543 | 3 | ↓ |