In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 27 | 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) | 2.96 | 6.67 | -13.03 | 2 | 5 | 0 | 69 | 383.517 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.96 | 9.28 | -45.57 | 3 | 5 | 1 | 70 | 384.525 | 6 | ↓ |