In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 26 | 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) | -0.41 | 4.3 | -90.43 | 1 | 7 | 0 | 89 | 381.45 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.41 | 2.07 | -54.99 | 0 | 7 | -1 | 88 | 380.442 | 3 | ↓ |