In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 17th, 2006 | 26 | No |
Popular Name: 2-acetyl-6-amino-8-(1-cyclohex-2-enyl)-1,3,8,8a-tetrahydroisoquinoline-5,7,7-tricarbonitrile 2-acetyl-6-amino-8-(1-cyclohex-2…
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) | 1.58 | 6.54 | -11.22 | 2 | 6 | 0 | 118 | 347.422 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.66 | 0.83 | -45.5 | 2 | 6 | 1 | 117 | 348.43 | 1 | ↓ |