UCSF

ZINC22010801

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 27 No

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) 4.14 7.19 -25.37 2 6 0 80 364.401 6
Hi High (pH 8-9.5) 4.14 7.99 -74.72 1 6 -1 83 363.393 6

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