UCSF

ZINC42779892

Substance Information

In ZINC since Heavy atoms Benign functionality
May 4th, 2010 16 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) 3.85 8.76 -41.89 1 1 1 4 297.138 5
Mid Mid (pH 6-8) 3.85 6.7 -3.63 0 1 0 3 296.13 5

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