UCSF

ZINC29308105

Substance Information

In ZINC since Heavy atoms Benign functionality
March 12th, 2009 21 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) -1.44 -5.66 -33.7 3 11 0 163 293.243 3
Hi High (pH 8-9.5) -0.99 -6.72 -62.28 2 11 -1 166 292.235 3

Activity (Go SEA)

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