UCSF

ZINC05757935

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2006 9 No

CAS Numbers: 63885-09-6 , [52738-99-5]

Other Names:

6-Methylheptanal

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) 3.07 2.34 -4.9 0 1 0 17 128.215 5

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