In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 17 | 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) | -0.32 | -0.09 | -12.25 | 4 | 7 | 0 | 110 | 237.263 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.32 | 0.17 | -38.57 | 5 | 7 | 1 | 111 | 238.271 | 5 | ↓ |
Lo Low (pH 4.5-6) | -0.32 | -4.2 | -36.15 | 5 | 7 | 1 | 111 | 238.271 | 5 | ↓ |