In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 15th, 2006 | 28 | Yes |
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) | 3.33 | 12.43 | -10.41 | 0 | 4 | 0 | 38 | 401.844 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 12.74 | -35.74 | 1 | 4 | 1 | 39 | 402.852 | 6 | ↓ |