UCSF

ZINC62839321

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 15th, 2011 20 Yes

Popular Name: N-[3-(2-aminoethoxy)phenyl]thieno[3,2-c]pyridin-4-amine N-[3-(2-aminoethoxy)phenyl]thien…

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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) 2.76 5.89 -47.58 4 4 1 62 286.38 5 ↓
Hi High (pH 8-9.5) 2.76 5.45 -8.37 3 4 0 60 285.372 5 ↓
Mid Mid (pH 6-8) 2.76 6 -82.69 5 4 2 63 287.388 5 ↓

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

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