UCSF

ZINC09422382

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2007 30 No

Popular Name: N-[acetyl-ethyl-oxo-(3-pyridylmethyl)BLAHyl]acetamide N-[acetyl-ethyl-oxo-(3-pyridylme…

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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) 1.05 -0.85 -20.66 1 8 0 94 423.498 4 ↓
Lo Low (pH 4.5-6) 1.05 -0.74 -47.14 2 8 1 96 424.506 4 ↓

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