UCSF

ZINC39126063

Substance Information

In ZINC since Heavy atoms Benign functionality
February 5th, 2010 13 Yes

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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) -1.34 -3.01 -50.95 6 5 1 100 188.251 6
Hi High (pH 8-9.5) -1.34 -3.3 -13.61 5 5 0 98 187.243 6

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

No pre-computed analogs available. Try a structural similarity search.