UCSF

ZINC01014689

Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 23 No

Download: MOL2 SDF SMILES Flexibase

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) 5.59 11.29 -7.77 0 3 0 34 322.433 4
Ref Reference (pH 7) 5.59 10.64 -8.12 0 3 0 34 322.433 4

Activity (Go SEA)

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