| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2004 | 27 | No |
Popular Name: 2-amino-4-(3,4-dimethoxyphenyl)-4a,5,6,7-tetrahydro-1,3,3(4H)-naphthalenetricarbonitrile 2-amino-4-(3,4-dimethoxyphenyl)-…
1,3,3(4H)-naphthalenetricarbonitrile, 2-amino-4-(3,4-dimethoxyphenyl)-4a,5,6,7-tetrahydro-
2-amino-4-(3,4-dimethoxyphenyl)-4a,5,6,7-tetrahydronaphthalene-1,3,3(4H)-tricarbonitrile
| 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) | 3.26 | 7.31 | -11.7 | 2 | 6 | 0 | 116 | 360.417 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.26 | 7.12 | -53.96 | 3 | 6 | 1 | 117 | 361.425 | 3 | ↓ |
