In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 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) | -1.00 | 5.74 | -96.65 | 3 | 7 | 0 | 102 | 393.39 | 4 | ↓ |
Mid Mid (pH 6-8) | -3.74 | 4.78 | -71.22 | 4 | 7 | 1 | 105 | 394.398 | 3 | ↓ |