In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 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) | -0.70 | -1.24 | -14.25 | 4 | 7 | 0 | 110 | 223.236 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.70 | -0.97 | -34.17 | 5 | 7 | 1 | 111 | 224.244 | 4 | ↓ |
Lo Low (pH 4.5-6) | -0.70 | -5.36 | -34.24 | 5 | 7 | 1 | 111 | 224.244 | 4 | ↓ |