UCSF

ZINC72284347

Substance Information

In ZINC since Heavy atoms Benign functionality
May 16th, 2012 17 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) 2.33 6.43 -36.6 3 3 1 40 235.351 4
Lo Low (pH 4.5-6) 2.33 6.29 -86.44 4 3 2 41 236.359 4

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

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