In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 28 | 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) | 2.11 | 3.99 | -15.34 | 4 | 7 | 0 | 117 | 371.4 | 3 | ↓ |
Ref Reference (pH 7) | 2.11 | 3.38 | -15.05 | 4 | 7 | 0 | 117 | 371.4 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.11 | 4.21 | -62.96 | 5 | 7 | 1 | 118 | 372.408 | 3 | ↓ |