In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 22nd, 2008 | 26 | Yes |
None
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) | 2.35 | 8.05 | -16.8 | 1 | 6 | 0 | 67 | 360.502 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.35 | 8.18 | -41.25 | 2 | 6 | 1 | 68 | 361.51 | 6 | ↓ |