In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2006 | 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) | 2.33 | 7.67 | -17.95 | 1 | 8 | 0 | 134 | 431.496 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 1.85 | -47.19 | 2 | 8 | 1 | 135 | 432.504 | 5 | ↓ |