In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 26 | Yes |
None
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) | 1.11 | 7.36 | -101.53 | 3 | 7 | 0 | 106 | 362.405 | 3 | ↓ |
Lo Low (pH 4.5-6) | -2.48 | 6.41 | -77.95 | 4 | 7 | 1 | 109 | 363.413 | 2 | ↓ |