UCSF

ZINC40103119

Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 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) 7.83 15.71 -63.79 0 5 -1 70 531.072 10
Lo Low (pH 4.5-6) 7.83 14.95 -16.08 1 5 0 67 532.08 10

Activity (Go SEA)

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