In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | 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) | -0.33 | 1.29 | -36.19 | 3 | 6 | 1 | 76 | 299.391 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.33 | 0.09 | -12.7 | 2 | 6 | 0 | 71 | 298.383 | 5 | ↓ |