UCSF

ZINC49487819

Substance Information

In ZINC since Heavy atoms Benign functionality
September 30th, 2010 19 No

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Annotations

Vendors

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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) -0.49 -2.28 -7.53 3 6 0 85 283.353 5
Lo Low (pH 4.5-6) -0.49 0.08 -39.45 4 6 1 86 284.361 5

Activity (Go SEA)

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