In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 23 | 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) | 1.36 | -0.65 | -16.72 | 4 | 7 | 0 | 117 | 312.329 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.36 | 0.34 | -60.4 | 5 | 7 | 1 | 119 | 313.337 | 3 | ↓ |