In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 38 | 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) | 3.17 | 10.39 | -14.23 | 0 | 9 | 0 | 78 | 509.614 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 10.81 | -43.94 | 1 | 9 | 1 | 79 | 510.622 | 5 | ↓ |