UCSF

ZINC36332541

Substance Information

In ZINC since Heavy atoms Benign functionality
October 26th, 2009 18 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) -0.94 -1.82 -18.23 4 7 0 118 272.33 2
Lo Low (pH 4.5-6) -0.94 -1.69 -46.28 5 7 1 119 273.338 2

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

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