| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2009 | 44 | No |
Popular Name: BRD-K73500942-001-01-5 BRD-K73500942-001-01-5
| 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) | 3.98 | 12.35 | -19.42 | 2 | 12 | 0 | 172 | 622.708 | 15 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AT2A1-1-E | Sarcoplasmic/endoplasmic Reticulum Calcium ATP-ase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 10 | 0.25 | Binding ≤ 10μM |
| AT2A2-1-E | Sarcoplasmic/endoplasmic Reticulum Calcium ATPase 2 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 10 | 0.25 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| AT2A1_HUMAN | O14983 | Sarcoplasmic/endoplasmic Reticulum Calcium ATPase 1, Human | 9.8 | 0.25 | Binding ≤ 1μM |
| AT2A2_HUMAN | P16615 | Sarcoplasmic/endoplasmic Reticulum Calcium ATPase 2, Human | 9.8 | 0.25 | Binding ≤ 1μM |
| AT2A1_HUMAN | O14983 | Sarcoplasmic/endoplasmic Reticulum Calcium ATPase 1, Human | 9.8 | 0.25 | Binding ≤ 10μM |
| AT2A2_HUMAN | P16615 | Sarcoplasmic/endoplasmic Reticulum Calcium ATPase 2, Human | 9.8 | 0.25 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Ion transport by P-type ATPases | |
| Pre-NOTCH Processing in Golgi | |
| Reduction of cytosolic Ca++ levels |
