UCSF

ZINC39907713

Substance Information

In ZINC since Heavy atoms Benign functionality
March 15th, 2010 24 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) 3.96 10.76 -12.4 0 4 0 36 322.408 7
Mid Mid (pH 6-8) 3.96 11.11 -29.64 1 4 1 38 323.416 7

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