UCSF

ZINC22171730

Substance Information

In ZINC since Heavy atoms Benign functionality
December 13th, 2008 21 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) 2.23 6.33 -116.54 4 4 2 51 294.439 7
Mid Mid (pH 6-8) 2.23 4.8 -45.74 3 4 1 49 293.431 7

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