UCSF

ZINC40192562

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2010 34 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) 4.27 12.96 -23.15 1 7 0 76 476.964 9
Mid Mid (pH 6-8) 4.27 13.4 -39.42 2 7 1 78 477.972 9

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