UCSF

ZINC49512195

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2010 33 No

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Annotations

None

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) 1.05 8.51 -54.95 3 8 1 86 448.547 6
Mid Mid (pH 6-8) 1.05 6.29 -13.53 2 8 0 85 447.539 6

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