UCSF

ZINC42303261

Substance Information

In ZINC since Heavy atoms Benign functionality
April 27th, 2010 15 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 3.44 5.41 -48.9 3 2 1 37 228.743 5
Hi High (pH 8-9.5) 3.44 5 -3.71 2 2 0 35 227.735 5

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