In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | 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) | 4.08 | 9.16 | -36.15 | 1 | 2 | 1 | 22 | 305.261 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.08 | 7.18 | -4.52 | 0 | 2 | 0 | 20 | 304.253 | 7 | ↓ |