In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 9th, 2007 | 35 | 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) | 4.22 | -1.56 | -16.15 | 1 | 6 | 0 | 72 | 483.572 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.22 | -1.44 | -50.03 | 2 | 6 | 1 | 73 | 484.58 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.22 | -1.42 | -46.29 | 2 | 6 | 1 | 73 | 484.58 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.22 | -1.31 | -87.64 | 3 | 6 | 2 | 75 | 485.588 | 8 | ↓ |