| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 27th, 2005 | 24 | No |
Popular Name: Tranilast Tranilast
Find On: PubMed — Wikipedia — Google
CAS Numbers: 104931-56-8 , 1121-22-8 , 53902-12-8 , 53902-12-8; 53902-12-8 , 53902-12-8; 53902-17-3 , 53902-17-3 , [1121-22-8] , [53902-12-8]
(1R,2R)-1,2-Cyclohexanediamine
2-[3-(3,4-Dimethoxy-phenyl)-acryloylamino]-benzoic acid
2-{[(2E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]amino}benzoic acid
53902-12-8; D02027; Rizaben (TN); Tranilast (JP16/USAN/INN)
benzoic acid, 2-[[(2E)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propenyl]amino]-
CPD000058373; SAM001246737; TRANILAST
DIMETHOXYPHENYLACRYLOYLAMINOBENZOICACI
MK 341; MK-341; N-(3,4-Dimethoxycinnamoyl)anthranilic acid
Steroidal and non-steroidal inhibitors
| 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) | 3.16 | 7.78 | -49.36 | 1 | 6 | -1 | 88 | 326.328 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 166-168° | Matrix Scientific |
| MP | 211 - 213 °C | Fluorochem |
| ALOGPS_SOLUBILITY | 8.40e-03 g/l | DrugBank-experimental |
| Purity | >98% | Fluorochem |
| Therapy | antiallergic, mast cell degranulation inhibitor, angiogenesis blocker | SMDC Iconix |
| Indications | antiasthmatic, antifibrotic, anticancer, antiallergic | KeyOrganics Bioactives |
| Target | Immunology & Inflammation related | Selleck Chemicals |
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Sequoia Research Products Ltd.; NCC_SUPPLIER_STRUCTURE_ID : SRP02572t | NIH Clinical Collection via PubChem |
| Target | Others | Selleck Chemicals |
| PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: Sequoia Research Products Ltd.; SUPPLIER_STRUCTURE_ID: SRP02572t | NIH Clinical Collection via PubChem |
