In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 34 | 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) | 4.25 | 11.55 | -20.23 | 1 | 7 | 0 | 75 | 452.514 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.25 | 12.01 | -53.23 | 2 | 7 | 1 | 76 | 453.522 | 7 | ↓ |