UCSF

ZINC38741310

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2010 34 Yes

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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) 6.00 13.96 -47.23 1 7 -1 96 478.642 7
Mid Mid (pH 6-8) 5.54 15.35 -15.51 2 7 0 93 479.65 7

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

No pre-computed analogs available. Try a structural similarity search.