In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 25 | Yes |
Popular Name: hydroxy-pentamethyl-BLAHone hydroxy-pentamethyl-BLAHone
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) | 3.64 | 1.54 | -12.56 | 1 | 5 | 0 | 68 | 342.391 | 0 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80897-1-O | H9 (T-lymphoid Cells) (cluster #1 Of 2), Other | Other | 2600 | 0.31 | ADME/T ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80897 | Z80897 | H9 (T-lymphoid Cells) | 2600 | 0.31 | ADME/T ≤ 10μM |