In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 37 | 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) | 0.78 | 3.49 | -66.4 | 1 | 11 | -1 | 136 | 514.507 | 11 | ↓ |
Lo Low (pH 4.5-6) | 0.78 | 2.74 | -23.4 | 2 | 11 | 0 | 133 | 515.515 | 11 | ↓ |