In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 25th, 2007 | 27 | 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) | 2.21 | 6.45 | -12.5 | 0 | 6 | 0 | 69 | 360.369 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.21 | 1.86 | -115.99 | 2 | 6 | 2 | 71 | 362.385 | 3 | ↓ |