UCSF

ZINC01561957

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2004 13 Yes

Popular Name: (1S)-2-keto-1-methyl-cyclohexanecarboxylic-acid-ethyl-ester (1S)-2-keto-1-methyl-cyclohexane…

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CAS Number: N/A

Other Names:

MFCD00599370

N/A

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) 1.75 6.43 -9.87 0 3 0 43 184.235 3 ↓

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