UCSF

ZINC04885689

Substance Information

In ZINC since Heavy atoms Benign functionality
January 9th, 2006 29 No

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) 3.42 9.35 -56.86 2 6 1 80 397.426 4
Mid Mid (pH 6-8) 3.42 8.4 -13.32 1 6 0 76 396.418 4

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