In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2004 | 23 | 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) | 2.15 | 7.93 | -12.95 | 1 | 8 | 0 | 91 | 315.333 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.40 | 6.85 | -33.26 | 0 | 8 | -1 | 97 | 314.325 | 4 | ↓ |