In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 29th, 2008 | 30 | Yes |
Popular Name: N-(3,4-dimethoxyphenyl)-6-morpholino-N'-phenyl-1,3,5-triazine-2,4-diamine N-(3,4-dimethoxyphenyl)-6-morpho…
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) | 4.38 | -2.31 | -10.44 | 2 | 9 | 0 | 94 | 408.462 | 7 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80928-6-O | HCT-116 (Colon Carcinoma Cells) (cluster #6 Of 9), Other | Other | 920 | 0.28 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80928 | Z80928 | HCT-116 (Colon Carcinoma Cells) | 920 | 0.28 | Functional ≤ 10μM |