In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 2nd, 2010 | 29 | 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) | 1.17 | 1.14 | -16.95 | 6 | 10 | 0 | 152 | 398.423 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.17 | 1.52 | -32.95 | 7 | 10 | 1 | 153 | 399.431 | 4 | ↓ |