In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2005 | 32 | 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) | 1.57 | -0.67 | -15 | 1 | 8 | 0 | 95 | 434.496 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.57 | -0.56 | -43.28 | 2 | 8 | 1 | 96 | 435.504 | 5 | ↓ |