UCSF

ZINC38735883

Substance Information

In ZINC since Heavy atoms Benign functionality
January 28th, 2010 30 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) 2.64 4.98 -189.21 4 8 3 113 451.956 8
Mid Mid (pH 6-8) 2.64 3.76 -137.3 3 8 2 112 450.948 8

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