In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 4th, 2010 | 26 | 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) | 2.44 | 5.97 | -41.56 | 3 | 7 | 1 | 80 | 362.498 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 4.75 | -15.74 | 2 | 7 | 0 | 79 | 361.49 | 8 | ↓ |