In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 34 | 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) | 1.55 | 7.01 | -22.38 | 0 | 9 | 0 | 81 | 467.522 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.55 | 9.26 | -67.21 | 1 | 9 | 1 | 82 | 468.53 | 6 | ↓ |