| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2006 | 25 | No |
Popular Name: 4-benzylidene-5-imino-8-(o-tolyl)-9-thia-2,6,7-triazabicyclo[4.3.0]nona-1,7-dien-3-one 4-benzylidene-5-imino-8-(o-tolyl…
| 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) | 2.64 | 8.47 | -10.61 | 1 | 5 | 0 | 71 | 346.415 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.64 | 8.43 | -11.3 | 1 | 5 | 0 | 71 | 346.415 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.64 | 8.37 | -30.38 | 2 | 5 | 1 | 73 | 347.423 | 2 | ↓ |
