UCSF

ZINC49750613

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2010 22 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) 2.89 9.63 -57.58 2 4 1 57 300.426 5
Mid Mid (pH 6-8) 2.89 7.39 -12.13 1 4 0 56 299.418 5

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