UCSF

ZINC51762372

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2010 26 Yes

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) 0.37 6.41 -46.16 1 7 1 58 363.482 7
Hi High (pH 8-9.5) 0.37 4.03 -15.74 0 7 0 56 362.474 7
Lo Low (pH 4.5-6) 0.37 8.57 -102.28 2 7 2 59 364.49 7

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