In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2006 | 19 | Yes |
Popular Name: 2-(o-tolyl)-3,7,9-triazabicyclo[4.3.0]nona-8,10-diene-4-carboxylic 2-(o-tolyl)-3,7,9-triazabicyclo[…
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) | -0.04 | 7.3 | -27.91 | 3 | 5 | 0 | 85 | 257.293 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.04 | 7.72 | -71.47 | 4 | 5 | 1 | 87 | 258.301 | 2 | ↓ |