In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 3rd, 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) | -1.10 | 0.16 | -57.19 | 9 | 13 | 1 | 194 | 468.498 | 9 | ↓ |
Lo Low (pH 4.5-6) | -2.06 | -0.22 | -163.15 | 11 | 13 | 2 | 197 | 469.506 | 8 | ↓ |