UCSF

ZINC41473077

Substance Information

In ZINC since Heavy atoms Benign functionality
April 20th, 2010 20 No

Download: MOL2 SDF SMILES Flexibase

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) 3.12 6.56 -26.01 2 3 1 35 287.408 3
Hi High (pH 8-9.5) 3.12 6.18 -8.33 1 3 0 34 286.4 3

Activity (Go SEA)

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