UCSF

ZINC16137690

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 22nd, 2008 29 Yes

Popular Name: 4-[[4-[[4-[(4-hydroxy-4-oxo-butanoyl)amino]cyclohexyl]methyl]cyclohexyl]amino]-4-oxo-butanoic 4-[[4-[[4-[(4-hydroxy-4-oxo-buta…

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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) 1.34 7.53 -103.88 2 8 -2 138 408.495 10 ↓
Mid Mid (pH 6-8) 1.34 6.41 -59.26 3 8 -1 136 409.503 10 ↓
Lo Low (pH 4.5-6) 1.34 5.29 -20.85 4 8 0 133 410.511 10 ↓

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