UCSF

ZINC32536622

Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2009 27 No

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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) 0.22 -1.45 -27.28 1 8 0 124 437.561 5
Lo Low (pH 4.5-6) 0.22 -0.29 -81.66 2 8 1 128 438.569 5

Activity (Go SEA)

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