UCSF

ZINC39884073

Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 34 No

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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) 1.74 8.49 -22.12 3 9 0 132 494.554 4
Mid Mid (pH 6-8) 1.50 6.95 -56.05 2 9 -1 135 493.546 5
Mid Mid (pH 6-8) 1.50 6.5 -53.45 2 9 -1 135 493.546 5
Mid Mid (pH 6-8) 1.50 6.58 -53.46 2 9 -1 135 493.546 5
Mid Mid (pH 6-8) 1.50 6.64 -67.36 2 9 -1 135 493.546 5
Mid Mid (pH 6-8) 1.50 6.71 -67.37 2 9 -1 135 493.546 5
Mid Mid (pH 6-8) 1.50 7.02 -57.93 2 9 -1 135 493.546 5
Mid Mid (pH 6-8) 1.50 7.11 -57.85 2 9 -1 135 493.546 5

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