In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 14th, 2008 | 33 | No |
None
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) | 2.98 | 1.84 | -59.99 | 1 | 7 | 1 | 75 | 445.495 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.98 | 1.95 | -122.36 | 2 | 7 | 2 | 76 | 446.503 | 5 | ↓ |