UCSF

ZINC37818725

Substance Information

In ZINC since Heavy atoms Benign functionality
December 2nd, 2009 20 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) 1.40 5.08 -45.31 2 4 1 46 297.375 2
Mid Mid (pH 6-8) 1.40 4.02 -11.53 1 4 0 42 296.367 2

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