In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2009 | 33 | 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) | 5.68 | 13.76 | -10.42 | 0 | 4 | 0 | 37 | 444.619 | 8 | ↓ |
Lo Low (pH 4.5-6) | 5.68 | 16.28 | -48.78 | 1 | 4 | 1 | 38 | 445.627 | 8 | ↓ |