In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 16th, 2009 | 33 | Yes |
None
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) | 6.60 | 17.42 | -39.23 | 1 | 2 | 1 | 8 | 433.619 | 7 | ↓ |
Mid Mid (pH 6-8) | 6.60 | 17.14 | -35.25 | 1 | 2 | 1 | 8 | 433.619 | 7 | ↓ |
Mid Mid (pH 6-8) | 6.60 | 15.29 | -4.3 | 0 | 2 | 0 | 6 | 432.611 | 7 | ↓ |