In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 20 | 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) | 2.26 | 8.69 | -10.26 | 0 | 3 | 0 | 33 | 331.213 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.26 | 8.87 | -43.29 | 1 | 3 | 1 | 34 | 332.221 | 4 | ↓ |