In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 12 | 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) | -0.04 | 2.53 | -101.34 | 4 | 3 | 2 | 41 | 176.304 | 8 | ↓ |
Mid Mid (pH 6-8) | -0.04 | 0.03 | -40.51 | 3 | 3 | 1 | 40 | 175.296 | 8 | ↓ |