In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2008 | 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) | 4.43 | 6.01 | -47.97 | 3 | 3 | 1 | 50 | 320.199 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.43 | 5.62 | -7.27 | 2 | 3 | 0 | 48 | 319.191 | 3 | ↓ |