In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2009 | 24 | 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) | 2.32 | 7.26 | -27.17 | 1 | 8 | 0 | 109 | 361.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 8.38 | -43.85 | 2 | 8 | 1 | 111 | 362.416 | 4 | ↓ |