UCSF

ZINC31867771

Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 26 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) 2.46 9.02 -55.56 3 5 1 63 372.514 9
Hi High (pH 8-9.5) 2.46 6.49 -21.85 2 5 0 61 371.506 9

Activity (Go SEA)

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