UCSF

ZINC22289396

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2008 22 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) -0.29 3.71 -14.64 3 8 0 104 299.338 3
Mid Mid (pH 6-8) -0.29 4.11 -43.45 4 8 1 105 300.346 3

Activity (Go SEA)

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