In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 14th, 2006 | 14 | Yes |
Popular Name: 2-(4-bromo-2,7,9-triazabicyclo[4.3.0]nona-1,3,5,8-tetraen-8-yl)acetic 2-(4-bromo-2,7,9-triazabicyclo[4…
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) | 1.01 | 3.47 | -53.58 | 1 | 5 | -1 | 82 | 255.051 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 3.76 | -47.13 | 2 | 5 | 0 | 83 | 256.059 | 2 | ↓ |