In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 34 | 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) | 6.15 | 16.86 | -49.27 | 3 | 5 | 1 | 64 | 465.964 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 9.2 | -32.35 | 2 | 7 | 0 | 93 | 405.454 | 8 | ↓ |