UCSF

ZINC87492962

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2013 26 No

Popular Name: 5-Bromo-6-chloro-3-indolyl-2-acetamido-2-deoxy-beta-D-glucopyranoside 5-Bromo-6-chloro-3-indolyl-2-ace…

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CAS Numbers: [5069-91-6] , [5609-91-6]

Other Names:

MFCD00798384

N/A

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Annotations

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Vendors

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) 0.05 -2.07 -45.57 4 8 -1 127 448.677 3 ↓
Hi High (pH 8-9.5) 0.05 -1.25 -121.96 3 8 -2 130 447.669 3 ↓
Lo Low (pH 4.5-6) 0.05 -2.65 -13.94 5 8 0 124 449.685 3 ↓

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

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