SARECYCLINE HYDROCHLORIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (2018)
Entry Type: Small molecule
Molecule Category: Salt
UNII: 36718856JR
Parent Compound: SARECYCLINE

Structure
InChI Key APPRLAGZQKOUFL-FIPJBXKNSA-N
Smile CON(C)Cc1ccc(O)c2c1C[C@H]1C[C@H]3[C@H](N(C)C)C(O)=C(C(N)=O)C(=O)[C@@]3(O)C(O)=C1C2=O.Cl
InChI
InChI=1S/C24H29N3O8.ClH/c1-26(2)18-13-8-11-7-12-10(9-27(3)35-4)5-6-14(28)16(12)19(29)15(11)21(31)24(13,34)22(32)17(20(18)30)23(25)33;/h5-6,11,13,18,28,30-31,34H,7-9H2,1-4H3,(H2,25,33);1H/t11-,13-,18-,24-;/m0./s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H30ClN3O8
Molecular Weight 523.97
AlogP 0.11
Hydrogen Bond Acceptor 10.0
Hydrogen Bond Donor 5.0
Number of Rotational Bond 5.0
Polar Surface Area 173.86
Molecular species ACID
Aromatic Rings 1.0
Heavy Atoms 35.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Acne Vulgaris 4 D000152 ClinicalTrials

Related Entries

Scaffolds

Parent

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Cardiac disorders
18.75
Respiratory, thoracic and mediastinal disorders
18.75
Gastrointestinal disorders
12.5
Nervous system disorders
12.5
Vascular disorders
12.5
Eye disorders
6.25
General disorders and administration site conditions
6.25
Psychiatric disorders
6.25
Skin and subcutaneous tissue disorders
6.25

Cross References

Resources Reference
ChEMBL CHEMBL2364633
FDA SRS 36718856JR
SureChEMBL SCHEMBL22205222
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