In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 12 | 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) | 0.91 | 6.18 | -120.28 | 0 | 4 | -2 | 80 | 170.164 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.91 | 4.18 | -43.62 | 1 | 4 | -1 | 77 | 171.172 | 5 | ↓ |