UCSF

ZINC35111720

Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2009 30 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) 5.20 11.09 -11.17 1 5 0 45 409.574 8
Mid Mid (pH 6-8) 5.20 13.35 -52.13 2 5 1 46 410.582 8

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