UCSF

ZINC44830889

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2010 21 No

Popular Name: (2S)-2-(4-pyrimidin-2-ylpiperazine-1-carbonyl)pentanethioamide (2S)-2-(4-pyrimidin-2-ylpiperazi…

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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) 0.69 6.87 -9.17 2 6 0 75 307.423 5 ↓

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