UCSF

ZINC41055983

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2010 25 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) 2.48 8.22 -17.99 2 6 0 88 356.765 4
Hi High (pH 8-9.5) 3.78 7.87 -48.99 1 6 -1 91 355.757 4

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