In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 21 | 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) | 2.87 | 7.09 | -11.73 | 0 | 5 | 0 | 51 | 281.315 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.87 | 7.53 | -24.27 | 1 | 5 | 1 | 53 | 282.323 | 2 | ↓ |