In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2009 | 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) | 1.32 | 6.68 | -34.86 | 3 | 10 | 0 | 130 | 522.027 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 5.61 | -63.26 | 2 | 10 | -1 | 136 | 521.019 | 10 | ↓ |