UCSF

ZINC63751261

Substance Information

In ZINC since Heavy atoms Benign functionality
June 5th, 2011 28 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) 2.45 7.2 -20.21 1 7 0 82 394.818 3
Mid Mid (pH 6-8) 2.64 4.97 -59.62 0 7 -1 88 393.81 3

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

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