In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2009 | 26 | 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) | 0.60 | 4.4 | -104.55 | 5 | 7 | 0 | 119 | 360.389 | 3 | ↓ |
Mid Mid (pH 6-8) | -2.99 | 3.5 | -79.06 | 6 | 7 | 1 | 122 | 361.397 | 2 | ↓ |