UCSF

ZINC32223961

Substance Information

In ZINC since Heavy atoms Benign functionality
April 25th, 2009 14 No

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Annotations

None

Vendors

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) 2.08 4.59 -37.1 0 4 -1 57 206.612 2
Lo Low (pH 4.5-6) 2.08 4.73 -9.23 1 4 0 59 207.62 2

Activity (Go SEA)

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