In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 15 | 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) | 3.11 | 8.13 | -102.92 | 3 | 2 | 2 | 21 | 214.397 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 7.04 | -31.1 | 2 | 2 | 1 | 16 | 213.389 | 7 | ↓ |