UCSF

ZINC35986234

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 16th, 2009 10 Yes

Popular Name: 1,3-Dihydropyrrolo[2,3-c]pyridin-2-one 1,3-Dihydropyrrolo[2,3-c]pyridin…

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CAS Numbers: 295327-22-9 , 54415-85-9 , 58043-01-9 , [54415-85-9]

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) 0.51 1.32 -27.66 2 3 0 49 134.138 0 ↓
Ref Reference (pH 7) 0.01 1.2 -7.58 1 3 0 42 134.138 0 ↓
Hi High (pH 8-9.5) 0.97 -0.09 -40 1 3 -1 52 133.13 0 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks
Purity 95% Fluorochem
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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