UCSF

ZINC58002870

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2011 18 Yes

Popular Name: N-[(6-methyl-3-pyridyl)methyl]thieno[3,2-c]pyridin-4-amine N-[(6-methyl-3-pyridyl)methyl]th…

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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) 2.01 7.12 -34.78 2 3 1 39 256.354 3 ↓
Hi High (pH 8-9.5) 2.01 6.76 -7.18 1 3 0 38 255.346 3 ↓
Lo Low (pH 4.5-6) 2.01 7.56 -86.85 3 3 2 40 257.362 3 ↓

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

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