UCSF

ZINC02013559

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2004 11 Yes

Popular Name: Isodecanol Isodecanol

Find On: PubMed — Wikipedia — Google

CAS Numbers: 25339-17-7 , 68526-85-2 , [68526-85-2]

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) 3.63 -0.38 -2.33 1 1 0 20 158.285 7 ↓

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