UCSF

ZINC39886232

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 22 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) 3.84 5.94 -8.76 2 4 0 65 310.378 2
Mid Mid (pH 6-8) 4.29 4.39 -46.1 1 4 -1 69 309.37 2

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