UCSF

ZINC44995957

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2010 16 Yes

Popular Name: N-methyl-3-(thieno[3,2-c]pyridin-4-ylamino)propanamide N-methyl-3-(thieno[3,2-c]pyridin…

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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) 1.17 3.57 -32.98 3 4 1 55 236.32 4 ↓
Hi High (pH 8-9.5) 1.17 3.21 -13.83 2 4 0 54 235.312 4 ↓

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

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