In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 32 | 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) | 3.53 | -2.11 | -19.78 | 1 | 6 | 0 | 83 | 461.568 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.53 | -1.99 | -45.73 | 2 | 6 | 1 | 84 | 462.576 | 2 | ↓ |