In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 5th, 2008 | 36 | No |
Popular Name: Cilnidipine Cilnidipine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 132203-70-4 , 80621-81-4 , [132203-70-4]
132203-70-4; Atelec (TN); Cilnidipine (JAN/INN); D01173
3-Cinnamyl 5-(2-methoxyethyl) 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
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) | 5.72 | 14.87 | -18.72 | 1 | 9 | 0 | 120 | 492.528 | 12 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
biological_use | Antihypertensive agent | ZereneX Building Blocks |
Purity | 99% | APIChem |
Indications | Antihypertensive | KeyOrganics Bioactives |
biological_use | Antihypertensive agent | IBScreen Bioactives IBScreen Bioactives |
Target | Calcium Channel | Selleck Chemicals |
mechanism | Calcium channel blocker | IBScreen Bioactives |
biological_use | Cardiovascular agent | IBScreen Bioactives |
Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
CAC1B-1-E | Voltage-gated N-type Calcium Channel Alpha-1B Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1600 | 0.23 | Functional ≤ 10μM |
CAC1C-1-E | Voltage-gated L-type Calcium Channel Alpha-1C Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1 | 0.35 | Functional ≤ 10μM |
CAC1D-1-E | Voltage-gated L-type Calcium Channel Alpha-1D Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1 | 0.35 | Functional ≤ 10μM |
CAC1S-1-E | Voltage-gated L-type Calcium Channel Alpha-1S Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 1 | 0.35 | Functional ≤ 10μM |
Z50466-1-O | Trypanosoma Cruzi (cluster #1 Of 8), Other | Other | 5620 | 0.20 | Functional ≤ 10μM |
Z80175-1-O | IMR-32 (Neuroblastoma Cells) (cluster #1 Of 2), Other | Other | 1600 | 0.23 | Functional ≤ 10μM |
Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
---|---|---|---|---|---|
Z80175 | Z80175 | IMR-32 (Neuroblastoma Cells) | 1600 | 0.23 | Functional ≤ 10μM |
Z50466 | Z50466 | Trypanosoma Cruzi | 5620 | 0.20 | Functional ≤ 10μM |
CAC1C_RAT | P22002 | Voltage-gated L-type Calcium Channel Alpha-1C Subunit, Rat | 1.1 | 0.35 | Functional ≤ 10μM |
CAC1D_RAT | P27732 | Voltage-gated L-type Calcium Channel Alpha-1D Subunit, Rat | 1.1 | 0.35 | Functional ≤ 10μM |
CAC1S_RAT | Q02485 | Voltage-gated L-type Calcium Channel Alpha-1S Subunit, Rat | 1.1 | 0.35 | Functional ≤ 10μM |
CAC1B_HUMAN | Q00975 | Voltage-gated N-type Calcium Channel Alpha-1B Subunit, Human | 1600 | 0.23 | Functional ≤ 10μM |
Description | Species |
---|---|
Depolarization of the Presynaptic Terminal Triggers the Opening of Calcium Chann |