In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 23 | 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) | 3.46 | 7.39 | -38.87 | 3 | 5 | 1 | 64 | 331.465 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.46 | 6.39 | -21.36 | 2 | 5 | 0 | 62 | 330.457 | 6 | ↓ |