UCSF

ZINC66054629

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 11 Yes

Popular Name: (3R)-5-bromo-3-methyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine (3R)-5-bromo-3-methyl-2,3-dihydr…

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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) 2.17 4.06 -4.33 1 2 0 25 213.078 0 ↓
Lo Low (pH 4.5-6) 2.17 4.49 -27.2 2 2 1 26 214.086 0 ↓

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

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