UCSF

ZINC48702568

Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2010 29 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 2.48 8.65 -42.38 3 6 1 66 399.49 6
Mid Mid (pH 6-8) 2.48 6.44 -8.47 2 6 0 65 398.482 6

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