In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 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) | 2.40 | 6.93 | -9.77 | 1 | 4 | 0 | 43 | 304.463 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.40 | 7.63 | -33.87 | 2 | 4 | 1 | 47 | 305.471 | 4 | ↓ |