UCSF

ZINC20830514

Substance Information

In ZINC since Heavy atoms Benign functionality
November 29th, 2008 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) 1.34 2.53 -21.13 2 8 0 93 404.492 8
Hi High (pH 8-9.5) 1.41 1.61 -56.71 1 8 -1 99 403.484 8

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