UCSF

ZINC53663594

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 24th, 2010 14 Yes

Popular Name: N-methyl-N-thieno[3,2-d]pyrimidin-4-yl-ethane-1,2-diamine N-methyl-N-thieno[3,2-d]pyrimidi…

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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) 0.33 3.4 -48.95 3 4 1 57 209.298 3 ↓
Hi High (pH 8-9.5) 0.33 3.01 -8.75 2 4 0 55 208.29 3 ↓

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

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