In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 22 | 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) | 3.24 | 8.03 | -8.58 | 0 | 4 | 0 | 41 | 316.426 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.24 | 7.93 | -39.19 | 1 | 4 | 1 | 42 | 317.434 | 3 | ↓ |