In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 35 | Yes |
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) | 4.97 | 11.18 | -16.11 | 1 | 7 | 0 | 86 | 482.565 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.97 | 11.47 | -54.55 | 2 | 7 | 1 | 87 | 483.573 | 5 | ↓ |