UCSF

ZINC06138405

Substance Information

In ZINC since Heavy atoms Benign functionality
March 7th, 2006 23 No

Other Names:

MFCD03237225

Download: MOL2 SDF SMILES Flexibase

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) 2.67 1.01 -12.2 0 6 0 74 317.341 7
Mid Mid (pH 6-8) 2.59 3.29 -10.55 0 6 0 74 317.341 6

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

No pre-computed analogs available. Try a structural similarity search.