| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2009 | 16 | Yes |
Popular Name: DNC011429 DNC011429
| 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) | 2.42 | 6.57 | -5.94 | 0 | 2 | 0 | 26 | 212.296 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 7.01 | -38.96 | 1 | 2 | 1 | 27 | 213.304 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 7.01 | -37.56 | 1 | 2 | 1 | 27 | 213.304 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| C11B1-1-E | Cytochrome P450 11B1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2640 | 0.49 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| C11B1_BOVIN | P15150 | Cytochrome P450 11B1, Bovin | 2640 | 0.49 | Functional ≤ 10μM |
