In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 31 | 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) | 3.01 | 3.79 | -37.15 | 3 | 8 | -1 | 126 | 430.469 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.47 | 1.02 | -119.47 | 2 | 8 | -2 | 129 | 429.461 | 3 | ↓ |