In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2011 | 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) | 3.00 | 4.06 | -44.06 | 0 | 8 | -1 | 103 | 507.26 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 6.71 | -11.73 | 1 | 8 | 0 | 100 | 508.268 | 5 | ↓ |