UCSF

ZINC36406991

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2009 19 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) 3.20 9.46 -87.62 2 3 2 22 277.799 2
Hi High (pH 8-9.5) 3.20 6.8 -3.6 0 3 0 19 275.783 2
Mid Mid (pH 6-8) 3.20 7.25 -33.21 1 3 1 21 276.791 2
Mid Mid (pH 6-8) 3.20 9.03 -40.27 1 3 1 21 276.791 2

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