UCSF

ZINC01386702

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2004 27 No

Popular Name: N'-(1,3-benzodioxol-5-ylmethylene)-1-methyl-3-(trifluoromethyl)-1H-thieno[2,3-c]pyrazole-5-carbohydrazide N'-(1,3-benzodioxol-5-ylmethylen…

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CAS Number: 865659-79-6

Other Names:

MFCD04125262

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) 3.88 0.1 -16.14 1 7 0 77 396.35 4 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 280 - 282 KeyOrganics

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Rings

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

No pre-computed analogs available. Try a structural similarity search.