UCSF

ZINC62027118

Substance Information

In ZINC since Heavy atoms Benign functionality
April 23rd, 2011 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) 7.53 15.4 -148.91 7 4 3 70 489.772 10
Mid Mid (pH 6-8) 7.53 15.17 -67.36 6 4 2 69 488.764 10

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