UCSF

ZINC40547569

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2010 37 No

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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) 3.85 6.8 -27.61 2 9 0 122 525.627 9
Mid Mid (pH 6-8) 3.85 7.57 -65.46 1 9 -1 125 524.619 9

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

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