In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 29 | No |
Popular Name: 3,3,6,6-tetramethyl-9-(3-nitrophenyl)-2,4,5,7,9,10-hexahydroacridine-1,8-dione 3,3,6,6-tetramethyl-9-(3-nitroph…
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) | 5.09 | 10.84 | -51.1 | 0 | 6 | -1 | 98 | 393.463 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.67 | 1.3 | -16.28 | 0 | 6 | 0 | 92 | 394.471 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.67 | 2.5 | -23.98 | 0 | 6 | 0 | 92 | 394.471 | 2 | ↓ |