In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2006 | 30 | 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) | 3.92 | 9.33 | -15.01 | 2 | 6 | 0 | 65 | 402.498 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.92 | 10.06 | -70.71 | 3 | 6 | 0 | 66 | 403.506 | 6 | ↓ |