In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2006 | 35 | 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) | 3.00 | 3.97 | -101.59 | 0 | 13 | -2 | 190 | 516.517 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 4 | -30.87 | 2 | 13 | 0 | 186 | 518.533 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 3.98 | -65.28 | 1 | 13 | -1 | 188 | 517.525 | 8 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 3.98 | -61.12 | 1 | 13 | -1 | 188 | 517.525 | 8 | ↓ |