UCSF

ZINC23283441

Substance Information

In ZINC since Heavy atoms Benign functionality
December 28th, 2008 24 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 4.94 10.58 -34.73 1 3 1 17 331.524 4
Mid Mid (pH 6-8) 4.94 9.08 -3.28 0 3 0 16 330.516 4

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