UCSF

ZINC03978358

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2005 28 No

CAS Number: 302-95-4

Other Names:

MFCD00064139

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) 4.25 -2.26 -50.04 2 4 -1 80 391.572 4

Activity (Go SEA)

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