UCSF

ZINC85549185

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 20th, 2013 27 No

Popular Name: BRN 0050824; D-erythro-alpha-D-Galacto-octopyranoside, 2-hydroxyethyl-6,8-dideoxy-7-O-methyl-6-(((1-methyl-2-pyrrolidinyl)carbonyl)amino)-1-thio-, (S)-; Desalitcetin; LS-70997; U-6340 BRN 0050824; D-erythro-alpha-D-G…

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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) -1.62 -3.69 -35.44 6 9 1 133 409.525 8 ↓
Hi High (pH 8-9.5) -1.62 -6.13 -12.43 5 9 0 132 408.517 8 ↓

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

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