In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2010 | 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) | 2.58 | 6.97 | -60.85 | 0 | 7 | -1 | 92 | 382.392 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.58 | 6.22 | -15.89 | 1 | 7 | 0 | 89 | 383.4 | 6 | ↓ |