UCSF

ZINC04234681

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2005 16 Yes

Popular Name: 3-(3,4-Dimethoxyphenyl)-1H-pyrazol-5-amine 3-(3,4-Dimethoxyphenyl)-1H-pyraz…

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CAS Numbers: 208519-08-8 , [208519-08-8]

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) 0.93 3.13 -40.62 3 5 1 71 220.252 3 ↓
Mid Mid (pH 6-8) 1.25 2.7 -34.1 4 5 1 74 220.252 3 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 131 - 133 KeyOrganics
Warnings IRRITANT Matrix Scientific

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