UCSF

ZINC39907941

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2010 24 Yes

Download: MOL2 SDF SMILES Flexibase

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Vendors

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) 5.42 10.99 -7.61 0 3 0 31 354.24 3
Lo Low (pH 4.5-6) 5.42 11.32 -28.3 1 3 1 32 355.248 3

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