In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 4th, 2010 | 35 | 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) | 1.87 | 6.19 | -49.34 | 4 | 9 | 1 | 100 | 478.573 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.87 | 3.81 | -12.68 | 3 | 9 | 0 | 99 | 477.565 | 8 | ↓ |