In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 15 | 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) | 1.79 | 4.8 | -70.7 | 2 | 4 | 0 | 66 | 207.229 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.79 | 3.34 | -51.24 | 1 | 4 | -1 | 61 | 206.221 | 3 | ↓ |