In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 30 | 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) | 3.70 | 10.98 | -17.44 | 1 | 8 | 0 | 97 | 436.522 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.70 | 11.38 | -50.37 | 2 | 8 | 1 | 99 | 437.53 | 4 | ↓ |