UCSF

ZINC31867635

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 31 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) 1.84 6.19 -33.28 2 7 0 105 437.521 8
Lo Low (pH 4.5-6) 1.84 6.65 -65.1 3 7 1 106 438.529 8

Activity (Go SEA)

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