In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 32 | 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) | 2.11 | 6.56 | -23.33 | 1 | 10 | 0 | 121 | 439.403 | 7 | ↓ |
Ref Reference (pH 7) | 2.11 | 5.46 | -18.32 | 1 | 10 | 0 | 121 | 439.403 | 7 | ↓ |
Ref Reference (pH 7) | 2.11 | 5.42 | -16.72 | 1 | 10 | 0 | 121 | 439.403 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 4.74 | -68.32 | 2 | 10 | 1 | 122 | 440.411 | 7 | ↓ |