UCSF

ZINC38907552

Substance Information

In ZINC since Heavy atoms Benign functionality
January 31st, 2010 32 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) 5.46 12.58 -14.22 0 5 0 41 432.612 9
Mid Mid (pH 6-8) 5.46 14.6 -39.22 1 5 1 43 433.62 9
Lo Low (pH 4.5-6) 5.46 15.77 -128.3 2 5 2 44 434.628 9
Lo Low (pH 4.5-6) 5.46 15.07 -54.01 1 5 1 43 433.62 9

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