UCSF

ZINC28285063

Substance Information

In ZINC since Heavy atoms Benign functionality
February 26th, 2009 20 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) 2.07 9.09 -47.99 1 4 1 42 293.774 4
Mid Mid (pH 6-8) 2.07 6.75 -10.44 0 4 0 41 292.766 4

Activity (Go SEA)

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