In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2004 | 27 | No |
81110-73-8; D08464; Hidrasec (TN); Racecadotril (INN); Tiorfan (TN)
81110-73-8; Prestwick_926; Racecadotril
Benzyl 2-(3-(acetylthio)-2-benzylpropanamido)acetate
Benzyl2-(3-(acetylthio)-2-benzylpropanamido)acetate
CPD000449320; Glycine, N-[2-[(acetylthio)methyl]-1-oxo-3-phenylpropyl]-,phenylmethyl ester [CAS]
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) | 3.83 | 10.91 | -9.5 | 1 | 5 | 0 | 72 | 385.485 | 11 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Purity | 95% | Fluorochem |
Therapy | antidiarrheal | SMDC Pharmakon |
PUBCHEM_SUBSTANCE_COMMENT | NCC_SAMPLE_SUPPLIER : Tocris Cookson Ltd.; NCC_SUPPLIER_STRUCTURE_ID : 101458 | NIH Clinical Collection via PubChem |
Target | Opioid Receptor | Selleck Chemicals |
PUBCHEM_SUBSTANCE_COMMENT | SAMPLE_SUPPLIER: Tocris Bioscience; SUPPLIER_STRUCTURE_ID: 101458 | NIH Clinical Collection via PubChem |