UCSF

ZINC37818599

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 21 Yes

Popular Name: (1-aminocyclopentyl)-[4-[(2-methylthiazol-4-yl)methyl]piperazin-1-yl]methanone (1-aminocyclopentyl)-[4-[(2-meth…

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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) 0.72 2.74 -48.42 3 5 1 64 309.459 3 ↓
Hi High (pH 8-9.5) 0.72 2.53 -8.31 2 5 0 62 308.451 3 ↓
Mid Mid (pH 6-8) 0.72 4.97 -107.79 4 5 2 65 310.467 3 ↓

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