UCSF

ZINC39885684

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 28 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) 4.26 11.16 -14.75 1 6 0 85 409.492 5
Hi High (pH 8-9.5) 4.33 9.52 -57.26 0 6 -1 91 408.484 5

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