UCSF

ZINC39636865

Substance Information

In ZINC since Heavy atoms Benign functionality
March 2nd, 2010 38 No

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Annotations

Vendors

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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) 1.47 8.21 -64.51 3 8 1 91 532.587 6
Lo Low (pH 4.5-6) 1.47 8.75 -111.5 4 8 2 93 533.595 6

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