In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2009 | 32 | 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) | 1.59 | 10.63 | -21.62 | 1 | 8 | 0 | 99 | 429.48 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.59 | 11.09 | -44.34 | 2 | 8 | 1 | 100 | 430.488 | 7 | ↓ |