UCSF

ZINC53682936

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 43 No

Popular Name: Lymecycline Lymecycline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 992-21-2 , [992-21-2]

Other Names:

(+)-N-(5-Amino-5-carboxypentylaminomethyl)-4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxonaphthacene-2-carboxamide; 2-Naphthacenecarboxamide, 4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pen

(+)-N-(5-Amino-5-carboxypentylaminomethyl)-4-dimethylamino-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxonaphthacene-2-carboxamide; N(2)-(((+)-5-Amino-5-carboxypentylamino)methyl)tetracycline; N-Lysinomethyltetracycline; N6-

cycline

7-Chlorotetracycline

7-Chlorotetracycline;Chlorotetracycline;Chlortetracyclin;Chlortetracycline;Chlortetracyclinium chloride;CLTC

992-21-2; D06884; Lymecycline (INN)

Acronize

Acronize PD

Aureocarmyl

Aureociclin

Aureociclina

Aureocina

Aureocycline

Aureomicina

Aureomycin

Aureomycin A-377

Aureomycin hydrochloride

Aureomycin monohydrochloride

Aureomykoin

Aurofac

Aurofac 10

Auxeomycin

B-Aureo

Biomitsin

Biomitsin hydrochloride

Biomycin A

Biomycin hydrochloride

Biovetin

Centraureo

Chlorotetracycline

Chlorotetracycline hydrochloride

Chlorotetracycline;Chlortetracyclinium chloride;Chlortetracycline;Chlortetracyclin;CLTC;7-Chlorotetracycline

Chlortetracyclin

Chlortetracycline

Chlortetracycline hydrochloride

Chlortetracyclinium chloride

Chrusomykine

Chrysomykine

Clorocipan

CLTC

Duomycin

Flamycin

INN

Isphamycin

limeciclina; lymecycline; lymecyclinum

Lymecycline (BAN

Lymecycline, Antibiotic for Culture Media Use Only

MFCD01716199

MI)

Orospray

Psittacin hydrochloride

Tetra 5

Tetralysal

Tetrlysal 300

Tocopherex

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) -2.84 -0.13 -96.02 10 14 0 255 602.641 10 ↓
Hi High (pH 8-9.5) -2.84 -1.75 -114.63 8 14 -2 249 600.625 10 ↓
Hi High (pH 8-9.5) -2.84 -1.43 -92.79 9 14 -1 250 601.633 10 ↓
Hi High (pH 8-9.5) -2.40 -0.1 -154.28 8 14 -2 253 600.625 10 ↓
Hi High (pH 8-9.5) -2.40 -0.43 -194.71 7 14 -3 251 599.617 10 ↓
Mid Mid (pH 6-8) -2.21 0.51 -132.91 10 14 0 262 602.641 10 ↓
Mid Mid (pH 6-8) -2.84 1.81 -110.55 11 14 1 256 603.649 10 ↓
Mid Mid (pH 6-8) -2.40 3.25 -129.49 10 14 0 259 602.641 10 ↓

Vendor Notes

Note Type Comments Provided By
ALOGPS_SOLUBILITY 1.31e+00 g/l DrugBank-approved
Indications antibiotic KeyOrganics Bioactives
PUBCHEM_PATENT_ID EP0064040A1; EP0096700A1; EP0126145A1; EP0126145B1; EP0391898A1; EP0394122A2; EP0493513B1; EP0507921A1; EP0654263A1; EP0665883A1; EP0786999A1; EP0792371A1; EP0831845A1; EP0831869A1; EP0852494A2; EP0885199A1; EP0970065A1; EP1021204A2; EP1037614A2; EP104743 IBM Patent Data

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.