In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2005 | 21 | Yes |
Popular Name: N~1~-(9-acridinyl)-N~3~,N~3~-dimethyl-1,3-propanediamine N~1~-(9-acridinyl)-N~3~,N~3~-dim…
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) | 3.86 | 9.63 | -76.13 | 3 | 3 | 2 | 31 | 281.403 | 5 | ↓ |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80089-1-O | CHO-AA8 (cluster #1 Of 2), Other | Other | 4 | 0.56 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80089 | Z80089 | CHO-AA8 | 4.3 | 0.56 | Functional ≤ 10μM |