| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2006 | 26 | Yes |
Popular Name: N,N-diethyl-4-(3-phenyl-2,6,7,9-tetrazabicyclo[4.3.0]nona-3,7,9-trien-5-yl)-aniline N,N-diethyl-4-(3-phenyl-2,6,7,9-…
| 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) | 3.95 | 14.02 | -13.45 | 0 | 5 | 0 | 46 | 345.45 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.95 | 14.13 | -59.16 | 1 | 5 | 0 | 48 | 346.458 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.95 | 14.65 | -47.96 | 2 | 5 | 0 | 49 | 347.466 | 5 | ↓ |
