UCSF

ZINC39856514

Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 29 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) 6.75 13.75 -17.25 1 4 0 51 449.403 7
Hi High (pH 8-9.5) 6.94 11.42 -47.61 0 4 -1 58 448.395 7

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