UCSF

ZINC06627043

Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 28 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) 3.73 12.4 -12.55 1 4 0 37 395.503 8
Lo Low (pH 4.5-6) 3.73 12.87 -46.09 2 4 1 39 396.511 8

Activity (Go SEA)

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