UCSF

ZINC36128222

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 33 No

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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) 0.92 6.7 -27.1 1 10 0 118 453.451 6
Mid Mid (pH 6-8) 0.92 6.18 -21.62 1 10 0 118 453.451 6
Mid Mid (pH 6-8) 0.92 7.26 -57.84 2 10 1 120 454.459 6

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

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