In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 14th, 2010 | 35 | 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) | 6.20 | 14.78 | -31.11 | 1 | 5 | 1 | 47 | 468.552 | 3 | ↓ |
Mid Mid (pH 6-8) | 6.20 | 14.68 | -15.98 | 0 | 5 | 0 | 46 | 467.544 | 3 | ↓ |