UCSF

ZINC00950117

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2004 28 Yes

Popular Name: 3-amino-4,6-dimethyl-N-(4-phenoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide 3-amino-4,6-dimethyl-N-(4-phenox…

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CAS Number: N/A

Other Names:

MFCD05256472

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) 5.12 -1.96 -11.68 3 5 0 77 389.48 4 ↓
Lo Low (pH 4.5-6) 5.12 -1.92 -37.27 4 5 1 78 390.488 4 ↓

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Rings

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

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