UCSF

ZINC48792984

Substance Information

In ZINC since Heavy atoms Benign functionality
September 19th, 2010 17 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) 2.25 8.22 -44.38 1 3 1 25 239.383 4
Mid Mid (pH 6-8) 2.25 6.01 -7.02 0 3 0 24 238.375 4

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