UCSF

ZINC34940113

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 19 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) 1.99 4.09 -54.71 3 4 1 59 324.198 4
Mid Mid (pH 6-8) 1.99 3.76 -8.02 2 4 0 57 323.19 4
Mid Mid (pH 6-8) 1.99 4.22 -38.46 3 4 1 59 324.198 4

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