UCSF

ZINC62038873

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 34 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) 5.06 9.35 -13.93 2 7 0 101 493.61 8
Hi High (pH 8-9.5) 5.06 10.13 -43.95 1 7 -1 104 492.602 8

Activity (Go SEA)

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