UCSF

ZINC23816869

Substance Information

In ZINC since Heavy atoms Benign functionality
January 8th, 2009 22 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) 1.94 3.5 -15.11 2 7 0 93 321.406 7
Hi High (pH 8-9.5) 1.94 4.28 -43.88 1 7 -1 96 320.398 7

Activity (Go SEA)

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