UCSF

ZINC01261423

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 14th, 2004 11 No

Popular Name: Isocyclocitral Isocyclocitral

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1423-46-7 , [1335-66-6]

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) 3.19 2.42 -4.34 0 1 0 17 152.237 1 ↓

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