In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2006 | 32 | 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) | 3.62 | 10.94 | -19.97 | 1 | 8 | 0 | 99 | 440.544 | 11 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 11.34 | -34.3 | 2 | 8 | 1 | 100 | 441.552 | 11 | ↓ |