UCSF

ZINC41058231

Substance Information

In ZINC since Heavy atoms Benign functionality
April 15th, 2010 21 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) 3.12 6.34 -11.69 1 4 0 51 278.311 3
Lo Low (pH 4.5-6) 3.12 6.76 -32.44 2 4 1 52 279.319 3
Lo Low (pH 4.5-6) 3.30 6.78 -30.62 2 4 1 56 279.319 2

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