UCSF

ZINC39899898

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 30 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) 6.62 13.94 -15.13 0 4 0 36 420.94 8
Lo Low (pH 4.5-6) 6.62 14.59 -30.83 1 4 1 38 421.948 8

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