In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 28th, 2006 | 44 | No |
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) | -5.34 | -17.25 | -138.35 | 8 | 21 | -1 | 323 | 662.422 | 11 | ↓ |
Lo Low (pH 4.5-6) | -5.34 | -17.11 | -150.76 | 9 | 21 | 0 | 325 | 663.43 | 11 | ↓ |