UCSF

ZINC39917166

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 23 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) 3.48 9.03 -39.01 1 4 1 26 315.485 5
Mid Mid (pH 6-8) 3.48 10.04 -81.96 2 4 2 27 316.493 5
Mid Mid (pH 6-8) 3.48 8.93 -34.54 1 4 1 26 315.485 5
Mid Mid (pH 6-8) 3.48 6.67 -8.01 0 4 0 24 314.477 5

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