UCSF

ZINC38571163

Substance Information

In ZINC since Heavy atoms Benign functionality
January 26th, 2010 34 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) 3.51 9.39 -34.55 1 8 1 91 460.51 6
Lo Low (pH 4.5-6) 3.51 10.01 -89.01 2 8 2 93 461.518 6

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

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