UCSF

ZINC69236561

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2011 18 Yes

Popular Name: N-(4,5-dihydro-3H-thieno[3,2-e]benzimidazol-2-ylmethyl)-2-methyl-propan-1-amine N-(4,5-dihydro-3H-thieno[3,2-e]b…

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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) 2.67 7.05 -44.66 3 3 1 45 262.402 4 ↓
Hi High (pH 8-9.5) 2.67 5.69 -6.04 2 3 0 41 261.394 4 ↓

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Rings

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

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