UCSF

ZINC04513863

Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2005 23 No

CAS Number: 130-49-4

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) -1.52 -10.13 -145.93 4 12 -2 191 345.208 4

Activity (Go SEA)

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