In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2008 | 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) | 2.30 | 10.06 | -89.95 | 3 | 6 | 2 | 54 | 387.572 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.30 | 7.76 | -45.34 | 2 | 6 | 1 | 53 | 386.564 | 7 | ↓ |