In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 22 | 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) | 5.53 | 12.67 | -9.13 | 0 | 2 | 0 | 17 | 349.231 | 2 | ↓ |
Lo Low (pH 4.5-6) | 5.53 | 13.11 | -30.62 | 1 | 2 | 1 | 19 | 350.239 | 2 | ↓ |