UCSF

ZINC62038805

Substance Information

In ZINC since Heavy atoms Benign functionality
April 24th, 2011 30 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) 4.41 8.33 -12.81 2 6 0 92 435.53 6
Hi High (pH 8-9.5) 4.41 9.13 -42.41 1 6 -1 95 434.522 6

Activity (Go SEA)

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