UCSF

ZINC63934786

Substance Information

In ZINC since Heavy atoms Benign functionality
June 8th, 2011 32 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) 3.98 7.97 -16.48 2 8 0 106 433.464 7
Mid Mid (pH 6-8) 3.23 6.93 -34.94 1 8 -1 112 432.456 6

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

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