UCSF

ZINC59632656

Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2011 33 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) -4.75 -2.17 -497.41 2 19 -5 305 557.107 10
Mid Mid (pH 6-8) -4.75 -3.33 -348.8 3 19 -4 302 558.115 10

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