UCSF

ZINC39884092

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) -0.35 3.26 -24.25 3 11 0 152 504.546 3
Mid Mid (pH 6-8) -0.59 1.87 -57.46 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 1.42 -54.62 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 1.5 -54.6 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 1.57 -70.21 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 1.65 -70.2 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 1.93 -58 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 2.02 -57.86 2 11 -1 156 503.538 4
Mid Mid (pH 6-8) -0.59 1.79 -57.58 2 11 -1 156 503.538 4

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