In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2009 | 35 | 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) | 4.20 | 10.87 | -69.28 | 1 | 8 | -1 | 124 | 490.561 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.66 | 9.7 | -127.14 | 0 | 8 | -2 | 128 | 489.553 | 5 | ↓ |