UCSF

ZINC37798114

Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 17 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) 0.47 3.06 -40.8 3 5 1 66 260.383 5
Mid Mid (pH 6-8) 0.47 1.95 -14.69 2 5 0 61 259.375 5

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