In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2008 | 25 | 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) | 0.84 | 3.86 | -11.89 | 0 | 8 | 0 | 78 | 358.435 | 12 | ↓ |
Lo Low (pH 4.5-6) | 0.84 | 6.08 | -43.46 | 1 | 8 | 1 | 79 | 359.443 | 12 | ↓ |