UCSF

ZINC40187477

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 23 Yes

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Annotations

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) 3.31 8.24 -12.89 1 5 0 56 309.369 4
Mid Mid (pH 6-8) 3.31 8.81 -33.56 2 5 1 57 310.377 4

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