UCSF

ZINC13425305

Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 30 No

Other Names:

MFCD02056111

Download: MOL2 SDF SMILES Flexibase

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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) 4.66 10.44 -34.27 2 5 1 55 421.487 3
Ref Reference (pH 7) 4.48 10.62 -10.42 1 5 0 50 420.479 3
Mid Mid (pH 6-8) 4.66 9.49 -6.8 1 5 0 53 420.479 3

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