UCSF

ZINC63731623

Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 23 Yes

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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) 1.53 6.34 -18.8 0 7 0 94 318.329 8
Mid Mid (pH 6-8) 1.53 7.34 -44.97 1 7 1 96 319.337 8

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

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