UCSF

ZINC48613725

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2010 23 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) 2.58 10.15 -41.92 1 4 1 28 330.477 5
Mid Mid (pH 6-8) 2.58 7.99 -9.26 0 4 0 27 329.469 5

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