In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 16 | No |
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) | 2.00 | 5.73 | -50.38 | 2 | 5 | 1 | 72 | 225.268 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 4.57 | -7.72 | 1 | 5 | 0 | 67 | 224.26 | 6 | ↓ |