UCSF

ZINC03978812

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 15 Yes

Popular Name: dihydrojasmonic acid dihydrojasmonic acid

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CAS Numbers: 76968-33-7 , 98674-52-3 , CAS# 98674-52-3 , [3572-64-3]

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) 2.59 8.05 -41.22 0 3 -1 57 211.281 6 ↓
Lo Low (pH 4.5-6) 2.59 6.06 -7.81 1 3 0 54 212.289 6 ↓

Vendor Notes

Note Type Comments Provided By
Therapy plant growth regulator SMDC MicroSource

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