UCSF

ZINC38337177

Substance Information

In ZINC since Heavy atoms Benign functionality
January 15th, 2010 22 No

CAS Number: 68-23-5

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) 3.41 7.95 -7.8 1 2 0 37 300.442 0

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