UCSF

ZINC38449979

Substance Information

In ZINC since Heavy atoms Benign functionality
January 23rd, 2010 31 Yes

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) 6.95 14.98 -7.85 1 3 0 38 427.617 9
Lo Low (pH 4.5-6) 6.95 15.45 -36.85 2 3 1 39 428.625 9

Activity (Go SEA)

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