In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 33 | Yes |
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 | 11.46 | -41.61 | 2 | 8 | 1 | 88 | 439.499 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 10.99 | -18.22 | 1 | 8 | 0 | 87 | 438.491 | 5 | ↓ |