UCSF

ZINC03873816

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2005 31 Yes

CAS Number: 27848-84-6

Other Names:

LS-64444

MFCD00869626

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) 3.85 1.38 -39.17 1 6 1 57 485.402 5

Activity (Go SEA)

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