In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2004 | 24 | 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) | 3.01 | 7.18 | -50.92 | 2 | 5 | 1 | 52 | 326.372 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.01 | 4.83 | -10.2 | 1 | 5 | 0 | 51 | 325.364 | 1 | ↓ |