In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2009 | 25 | Yes |
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) | 1.73 | 4.18 | -51.9 | 4 | 7 | 1 | 92 | 355.503 | 9 | ↓ |
Mid Mid (pH 6-8) | 1.73 | 2 | -20.09 | 3 | 7 | 0 | 91 | 354.495 | 9 | ↓ |