UCSF

ZINC22913759

Substance Information

In ZINC since Heavy atoms Benign functionality
December 22nd, 2008 24 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) 1.90 6.83 -32.39 1 5 1 39 330.452 9
Hi High (pH 8-9.5) 1.90 4.46 -6.51 0 5 0 38 329.444 9
Mid Mid (pH 6-8) 1.90 7.11 -38.07 1 5 1 39 330.452 9
Lo Low (pH 4.5-6) 1.90 7.54 -89.88 2 5 2 40 331.46 9

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