UCSF

ZINC39891059

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 27 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) 4.29 9.03 -26.25 2 6 0 80 403.891 6
Hi High (pH 8-9.5) 4.47 6.45 -54.71 1 6 -1 87 402.883 6

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