In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 21 | 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) | 2.91 | 5.94 | -9.66 | 0 | 4 | 0 | 41 | 310.463 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 7.55 | -48.84 | 1 | 4 | 1 | 42 | 311.471 | 5 | ↓ |