In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 39 | 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) | 3.76 | 13.09 | -17.74 | 0 | 7 | 0 | 62 | 527.665 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.76 | 15.38 | -54.84 | 1 | 7 | 1 | 64 | 528.673 | 8 | ↓ |