In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2007 | 32 | 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) | 6.01 | 12.84 | -61 | 0 | 5 | -1 | 73 | 479.99 | 4 | ↓ |
Mid Mid (pH 6-8) | 6.01 | 12.46 | -14.81 | 1 | 5 | 0 | 71 | 480.998 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.43 | -1.11 | -13.9 | 0 | 5 | 0 | 67 | 480.998 | 4 | ↓ |