UCSF

ZINC36221106

Substance Information

In ZINC since Heavy atoms Benign functionality
October 24th, 2009 13 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) 1.49 2.39 -25.13 5 4 1 64 181.263 3
Mid Mid (pH 6-8) 1.49 1.79 -5.78 4 4 0 63 180.255 3

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