UCSF

ZINC06627053

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 27 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) 2.30 10.56 -14.41 1 5 0 50 378.501 8
Lo Low (pH 4.5-6) 2.30 11.02 -43.79 2 5 1 52 379.509 8

Activity (Go SEA)

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