UCSF

ZINC39295337

Substance Information

In ZINC since Heavy atoms Benign functionality
February 12th, 2010 26 Yes

CAS Number: 42971-09-5

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) 4.13 12.05 -41.66 1 4 1 36 353.486 4

Activity (Go SEA)

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