| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 31 | Yes |
Popular Name: calcitetrol calcitetrol
(1S,3R,5Z,7E,24R,25)-9,10-secocholesta-5,7,10(19)-triene-1,3,24,25-tetrol
1alpha,24R,25(OH)3D3; 1alpha,24R,25-trihydroxycholecalciferol; 1alpha,24R,25-trihydroxyvitamin D3
None
| 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) | 4.41 | 3.93 | -6.57 | 4 | 4 | 0 | 81 | 432.645 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| UniProt Database Links | CP24A_HUMAN; CP24A_MOUSE; CP24A_RAT | ChEBI |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80437-1-O | RWLeu4 (cluster #1 Of 1), Other | Other | 11 | 0.36 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z80437 | Z80437 | RWLeu4 | 11 | 0.36 | Functional ≤ 10μM |
