UCSF

ZINC70188243

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2011 20 Yes

Popular Name: 2-[[4-(2-aminoethyl)-1-piperidyl]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[4-(2-aminoethyl)-1-piperidyl…

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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) 1.14 2.3 -96.79 4 5 1 81 293.416 4 ↓
Mid Mid (pH 6-8) 0.68 4.95 -112.24 5 5 2 78 294.424 4 ↓

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

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