In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 12 | No |
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) | 1.93 | 6.65 | -36.03 | 1 | 2 | 1 | 22 | 172.292 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.93 | 4.69 | -4.67 | 0 | 2 | 0 | 20 | 171.284 | 6 | ↓ |