UCSF

ZINC11536102

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
February 16th, 2008 15 No

Popular Name: 1-(4-Pyrrol-1-yl-phenyl)-ethanone oxime 1-(4-Pyrrol-1-yl-phenyl)-ethanon…

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CAS Numbers: , 832738-15-5

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) 2.16 5.64 -7.45 1 3 0 38 200.241 2 ↓
Ref Reference (pH 7) 2.16 5.64 -7.01 1 3 0 38 200.241 2 ↓

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

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