UCSF

ZINC39917139

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 33 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) 3.93 12.88 -47.11 1 6 1 44 449.619 11
Mid Mid (pH 6-8) 3.93 10.52 -12.65 0 6 0 43 448.611 11
Mid Mid (pH 6-8) 3.93 13.65 -91.5 2 6 2 45 450.627 11
Mid Mid (pH 6-8) 3.93 12.76 -44.39 1 6 1 44 449.619 11

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