UCSF

ZINC13517623

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 15 Yes

Popular Name: (1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-ylamino)-acetic acid (1-Methyl-1H-pyrazolo[3,4-d]pyri…

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CAS Number: 902034-31-5

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) -1.60 4.22 -41.27 1 7 -1 96 206.185 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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