UCSF

ZINC06603353

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2006 17 Yes

CAS Number: 36791-04-5

Other Names:

MFCD00058564

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) -2.77 -11.64 -21.52 5 9 0 143 244.207 3

Vendor Notes

Note Type Comments Provided By
MP 176 TCI

Activity (Go SEA)

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