In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 23 | Yes |
None
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) | 2.10 | -0.33 | -55.17 | 1 | 4 | 1 | 37 | 328.461 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.10 | -0.22 | -125.58 | 2 | 4 | 2 | 38 | 329.469 | 2 | ↓ |