UCSF

ZINC39916841

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 30 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) 4.03 7.94 -12.28 2 7 0 90 469.708 6
Lo Low (pH 4.5-6) 4.03 9.07 -40.35 3 7 1 94 470.716 6

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