UCSF

ZINC38907841

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2010 35 Yes

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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) 4.64 13.75 -14.8 0 5 0 41 460.581 5
Mid Mid (pH 6-8) 4.64 15.95 -52.86 1 5 1 43 461.589 5
Mid Mid (pH 6-8) 4.64 15.77 -38.38 1 5 1 43 461.589 5
Lo Low (pH 4.5-6) 4.64 16.6 -129.82 2 5 2 44 462.597 5

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