UCSF

ZINC21303370

Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2008 22 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) 1.04 6.29 -55.39 3 4 1 55 300.378 4
Hi High (pH 8-9.5) 1.04 6 -9.07 2 4 0 54 299.37 4

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