In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 28 | 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) | -0.49 | 2.34 | -63.19 | 1 | 8 | -1 | 116 | 402.452 | 8 | ↓ |
Lo Low (pH 4.5-6) | -0.49 | 1.45 | -17.97 | 2 | 8 | 0 | 113 | 403.46 | 8 | ↓ |