UCSF

ZINC42678480

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2010 19 Yes

Download: MOL2 SDF SMILES Flexibase

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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) 2.04 5.2 -10.97 0 4 0 50 296.779 4
Lo Low (pH 4.5-6) 2.04 5.66 -39.37 1 4 1 52 297.787 4

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