UCSF

ZINC39917143

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 25 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) 3.52 10.06 -42.8 1 4 1 26 355.893 4
Mid Mid (pH 6-8) 3.52 7.7 -9.08 0 4 0 24 354.885 4
Mid Mid (pH 6-8) 3.52 9.92 -44.78 1 4 1 26 355.893 4
Lo Low (pH 4.5-6) 3.52 10.36 -88.36 2 4 2 27 356.901 4

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