In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2011 | 29 | No |
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) | 1.72 | 2.71 | -52.43 | 1 | 8 | -1 | 114 | 395.391 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.26 | 5.14 | -15.77 | 2 | 8 | 0 | 111 | 396.399 | 6 | ↓ |