In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 36 | Yes |
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) | 4.96 | 9.44 | -17.68 | 2 | 8 | 0 | 97 | 493.604 | 13 | ↓ |
Mid Mid (pH 6-8) | 4.96 | 10.2 | -58.04 | 1 | 8 | -1 | 100 | 492.596 | 13 | ↓ |