In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 12th, 2008 | 33 | No |
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) | 4.64 | 10.2 | -54.94 | 0 | 9 | -1 | 134 | 444.423 | 4 | ↓ |
Ref Reference (pH 7) | 4.64 | 10.25 | -54.63 | 0 | 9 | -1 | 134 | 444.423 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.18 | 12.71 | -15.18 | 1 | 9 | 0 | 131 | 445.431 | 4 | ↓ |