UCSF

ZINC21986221

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 17 No

CAS Number: 76-75-5

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) 2.19 6.14 -6.28 1 3 0 46 255.383 5

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

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