In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 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) | 4.38 | 7.24 | -6.18 | 0 | 3 | 0 | 36 | 290.451 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.38 | 9.32 | -41.15 | 1 | 3 | 1 | 37 | 291.459 | 3 | ↓ |