In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2010 | 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) | 0.24 | 1.93 | -45.4 | 5 | 7 | 1 | 109 | 343.473 | 6 | ↓ |
Mid Mid (pH 6-8) | 0.24 | 1.29 | -17.65 | 4 | 7 | 0 | 105 | 342.465 | 6 | ↓ |