UCSF

ZINC34678951

Substance Information

In ZINC since Heavy atoms Benign functionality
September 21st, 2009 34 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) 1.56 8.77 -22.06 1 9 0 100 460.538 7
Lo Low (pH 4.5-6) 1.56 9.18 -49.91 2 9 1 102 461.546 7

Activity (Go SEA)

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