UCSF

ZINC20830484

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 32 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) 2.73 6.62 -19.2 1 8 0 84 470.576 6
Hi High (pH 8-9.5) 2.80 5.51 -56.44 0 8 -1 90 469.568 6

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