UCSF

ZINC38147910

Substance Information

In ZINC since Heavy atoms Benign functionality
January 5th, 2010 24 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) 5.56 11.24 -46.14 1 4 -1 70 335.464 15
Lo Low (pH 4.5-6) 5.56 9.26 -8.72 2 4 0 67 336.472 15

Activity (Go SEA)

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