UCSF

ZINC01020558

Substance Information

In ZINC since Heavy atoms Benign functionality
August 6th, 2004 14 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) -1.03 -0.04 -12.61 1 7 0 89 194.15 1
Mid Mid (pH 6-8) -1.03 0.19 -38.37 2 7 1 91 195.158 1

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

No pre-computed analogs available. Try a structural similarity search.