In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 6th, 2007 | 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) | 5.91 | 13.27 | -42.14 | 2 | 6 | 1 | 71 | 479.641 | 10 | ↓ |
Mid Mid (pH 6-8) | 4.88 | 13.93 | -43.7 | 1 | 6 | 1 | 68 | 479.641 | 11 | ↓ |