In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2010 | 23 | 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) | 3.33 | 10.25 | -58.19 | 2 | 3 | 1 | 53 | 300.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.33 | 8.9 | -9.76 | 1 | 3 | 0 | 49 | 299.377 | 5 | ↓ |