UCSF

ZINC00050373

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 Yes

Popular Name: 3-Amino-4,6-dimethyl-thieno[2,3- b ]pyridine-2-carbonitrile 3-Amino-4,6-dimethyl-thieno[2,3-…

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CAS Number: 52505-57-4

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) 2.23 -0.52 -8.94 2 3 0 63 203.27 0 ↓
Lo Low (pH 4.5-6) 2.23 -0.48 -34.86 3 3 1 64 204.278 0 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95+% Fluorochem

Activity (Go SEA)

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