In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2004 | 16 | 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) | 0.76 | 5.12 | -48.67 | 4 | 6 | 1 | 86 | 221.288 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.76 | 0.97 | -91.19 | 5 | 6 | 2 | 87 | 222.296 | 4 | ↓ |