UCSF

ZINC39970399

Substance Information

In ZINC since Heavy atoms Benign functionality
March 20th, 2010 23 No

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 3.58 9.93 -11.02 1 3 0 19 345.537 6
Mid Mid (pH 6-8) 3.58 12.16 -51.58 2 3 1 20 346.545 6

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