UCSF

ZINC19845588

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2008 19 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 3.52 5.18 -9.15 3 4 0 72 295.795 4
Hi High (pH 8-9.5) 3.97 4.41 -40.87 2 4 -1 75 294.787 4
Mid Mid (pH 6-8) 3.52 4.78 -18.4 3 4 0 72 295.795 4

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