UCSF

ZINC34370948

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2009 12 No

Popular Name: 2-hydroxy-3-isopropylbenzaldehyde 2-hydroxy-3-isopropylbenzaldehyde

Find On: PubMed — Wikipedia — Google

CAS Numbers: 67372-96-7 , [67372-96-7]

Other Names:

MFCD11040457

QA-0495

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) 2.45 3.47 -6.44 1 2 0 37 164.204 2 ↓

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