In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2009 | 40 | 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) | 5.35 | 17.03 | -53.63 | 1 | 6 | 1 | 60 | 535.643 | 8 | ↓ |
Hi High (pH 8-9.5) | 5.35 | 14.57 | -11.29 | 0 | 6 | 0 | 58 | 534.635 | 8 | ↓ |