In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2008 | 28 | 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) | 2.20 | 8.16 | -60.03 | 3 | 7 | 1 | 81 | 388.419 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.20 | 5.81 | -25.25 | 2 | 7 | 0 | 80 | 387.411 | 5 | ↓ |