UCSF

ZINC59859560

Substance Information

In ZINC since Heavy atoms Benign functionality
March 11th, 2011 27 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) 3.44 6.2 -49.57 0 6 -1 78 382.827 4
Lo Low (pH 4.5-6) 2.98 8.89 -9.88 1 6 0 75 383.835 4

Activity (Go SEA)

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