In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 31 | 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) | 0.26 | 0.97 | -65.63 | 6 | 9 | 1 | 134 | 432.497 | 12 | ↓ |
Hi High (pH 8-9.5) | 0.26 | -0.56 | -24.98 | 5 | 9 | 0 | 129 | 431.489 | 12 | ↓ |