UCSF

ZINC43163828

Substance Information

In ZINC since Heavy atoms Benign functionality
May 8th, 2010 19 Yes

CAS Number: 119520-05-7

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) 0.86 2.04 -46.88 4 5 1 75 262.333 2

Activity (Go SEA)

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