UCSF

ZINC39917402

Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 27 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) 5.06 12.82 -35.82 1 4 1 31 364.513 6
Hi High (pH 8-9.5) 5.06 10.88 -7.98 0 4 0 30 363.505 6

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