UCSF

ZINC20401605

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2008 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) 2.27 5.24 -46.74 3 3 1 40 263.405 6
Hi High (pH 8-9.5) 2.27 4.81 -3.24 2 3 0 38 262.397 6
Mid Mid (pH 6-8) 2.27 6.96 -33.66 3 3 1 40 263.405 6
Mid Mid (pH 6-8) 2.27 7.42 -113.96 4 3 2 41 264.413 6

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