| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2004 | 26 | Yes |
Popular Name: Cinacalcet Cinacalcet
Find On: PubMed — Wikipedia — Google
CAS Numbers: 226256-56-0 , 364782-34-3 , 694495-47-1 , [226256-56-0] , [364782-34-3]
(R)-N-(1-(Naphthalen-1-yl)ethyl)-3-(3-(trifluoro-methyl)phenyl)propan-1-amine hydrochloride
(R)-N-(1-(Naphthalen-1-yl)ethyl)-3-(3-(trifluoromethyl)phenyl)propan-1-amine hydrochloride
(R)-N-(1-(Naphthalen-1-yl)ethyl)-3-(3-(trifluoromethyl)phenyl)propan-1-aminehydrochloride
364782-34-3; Cinacalcet hydrochloride (JAN/USAN); D03505; Sensipar (TN)
AMG-073 HCl (Cinacalcet hydrochloride)
NAPHTHALENYLETHYLTRIFLUOROMETHYLPHENYLPROPANAMINEHYDROCHLORID
| 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) | 6.41 | 13.63 | -48.67 | 2 | 1 | 1 | 17 | 358.427 | 7 | ↓ |
| Hi High (pH 8-9.5) | 5.37 | 14.31 | -15.81 | 0 | 6 | 0 | 76 | 526.592 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 5.59e-05 g/l | DrugBank-approved |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Target | CaSR | Selleck Chemicals |
| UniProt Database Links | CNC_DROME; MAFG_BOVIN; MAFG_HUMAN; MAFG_MOUSE; MAFG_RAT; MAFK_HUMAN; MAFK_MOUSE; NF2L1_BOVIN; NF2L1_CHICK; NF2L1_HUMAN; NF2L1_MOUSE; NF2L1_PONAB; NF2L2_BOVIN; NF2L2_HUMAN; NF2L2_MOUSE; NF2L2_RAT; NF2L3_HUMAN; NF2L3_MOUSE; NFE2_BOVIN; NFE2_HUMAN; NFE2_MOUS | ChEBI |
| Patent Database Links | EP1914224; US2007054963; US2007060645; US2007185211; US2007207222; US2007238790; US2007248597; US2007249520; US2007259964; WO2007098089; WO2007098090; WO2007098091; WO2007103687; WO2007112280; WO2007124465 | ChEBI |
| Warnings | IRRITANT | Matrix Scientific |
