UCSF

ZINC08781724

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2007 34 No

Popular Name: N'-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N'-methyl-3-(3-methyl-5-oxo-1-phenyl-1,2,4-triazolan-3-yl)-4,5-dihydro-5-isoxazolecarbohydrazide N'-[3-chloro-5-(trifluoromethyl)…

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CAS Number: 338400-95-6

Other Names:

MFCD01315617

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) 2.60 -3.55 -22.45 3 10 0 111 497.865 6 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 168 - 170 KeyOrganics

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