In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2006 | 29 | 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) | 3.21 | 6.95 | -59.41 | 1 | 6 | -1 | 94 | 408.817 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.65 | -0.15 | -17.89 | 2 | 6 | 0 | 90 | 409.825 | 4 | ↓ |