UCSF

ZINC43427155

Substance Information

In ZINC since Heavy atoms Benign functionality
May 13th, 2010 17 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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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) 2.30 4.38 -37.31 2 3 1 29 241.399 5
Mid Mid (pH 6-8) 2.30 6.57 -104.6 3 3 2 30 242.407 5

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