In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2006 | 28 | 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) | 5.93 | 12.69 | -9.18 | 0 | 2 | 0 | 37 | 406.379 | 5 | ↓ |
Lo Low (pH 4.5-6) | 5.93 | 12.87 | -41.21 | 1 | 2 | 1 | 38 | 407.387 | 5 | ↓ |