In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 26 | No |
None
None
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) | 4.47 | 8.11 | -7.9 | 0 | 4 | 0 | 43 | 388.25 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.47 | 11.08 | -41.03 | 1 | 4 | 1 | 44 | 389.258 | 2 | ↓ |