BUCILLAMINE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: M01CC02
UNII: R80LRA5WTF

Structure
InChI Key VUAFHZCUKUDDBC-BYPYZUCNSA-N
Smile CC(C)(S)C(=O)N[C@@H](CS)C(=O)O
InChI
InChI=1S/C7H13NO3S2/c1-7(2,13)6(11)8-4(3-12)5(9)10/h4,12-13H,3H2,1-2H3,(H,8,11)(H,9,10)/t4-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C7H13NO3S2
Molecular Weight 223.32
AlogP 0.19
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 4.0
Polar Surface Area 66.4
Molecular species ACID
Aromatic Rings 0.0
Heavy Atoms 13.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Arthritis, Rheumatoid 3 D001172 ClinicalTrials
Severe Acute Respiratory Syndrome 3 D045169 ClinicalTrials
Gout 2 D006073 ClinicalTrials
Cystinuria 2 D003555 ClinicalTrials

Related Entries

MCS

Cross References

Resources Reference
CAS NUMBER 65002-17-7
ChEBI 31312
ChEMBL CHEMBL80830
DrugBank DB12160
DrugCentral 414
EPA CompTox DTXSID2048587
FDA SRS R80LRA5WTF
PharmGKB PA166123566
PubChem 656604
SureChEMBL SCHEMBL121965
ZINC ZINC000000020222
CONTENTS