UCSF

ZINC38837028

Substance Information

In ZINC since Heavy atoms Benign functionality
January 30th, 2010 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) 3.99 9.96 -22.99 0 6 0 80 486.018 6
Lo Low (pH 4.5-6) 3.99 10.42 -61.98 1 6 1 81 487.026 6

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