In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 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) | 5.83 | -0.19 | -9.83 | 0 | 5 | 0 | 64 | 472.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 6.01 | -0.08 | -10.55 | 0 | 5 | 0 | 64 | 472.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 6.01 | 1.14 | -10.45 | 0 | 5 | 0 | 64 | 472.368 | 7 | ↓ |
Mid Mid (pH 6-8) | 5.83 | 0.1 | -12.97 | 0 | 5 | 0 | 64 | 472.368 | 7 | ↓ |