UCSF

ZINC68308665

Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2011 28 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) 2.90 11.59 -23.09 0 8 0 96 385.42 9
Lo Low (pH 4.5-6) 2.90 12.34 -99.59 1 8 0 97 386.428 9

Activity (Go SEA)

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