UCSF

ZINC39693923

Substance Information

In ZINC since Heavy atoms Benign functionality
March 3rd, 2010 36 Yes

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) 2.83 10.6 -101.23 4 7 2 74 497.728 5
Mid Mid (pH 6-8) 2.83 8.24 -53.87 3 7 1 72 496.72 5

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