In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2006 | 31 | 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) | 4.12 | -1.7 | -11.44 | 0 | 0 | 0 | 83 | 492.366 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.30 | -1.64 | -12.4 | 0 | 7 | 0 | 83 | 492.366 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.30 | -0.43 | -12.12 | 0 | 7 | 0 | 83 | 492.366 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.12 | -1.73 | -14.68 | 0 | 7 | 0 | 83 | 492.366 | 7 | ↓ |