UCSF

ZINC32721134

Substance Information

In ZINC since Heavy atoms Benign functionality
May 8th, 2009 23 Yes

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) 2.75 5.61 -15.83 3 5 0 70 309.369 4
Ref Reference (pH 7) 2.75 5.62 -16.16 3 5 0 70 309.369 4

Activity (Go SEA)

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