UCSF

ZINC22055066

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 24 No

CAS Number: 34233-69-7

Other Names:

MFCD00210190

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) 2.85 9.66 -16.17 1 5 0 49 342.83 1
Hi High (pH 8-9.5) 2.85 10.9 -39.98 2 5 1 50 343.838 1

Activity (Go SEA)

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