UCSF

ZINC11616424

Substance Information

In ZINC since Heavy atoms Benign functionality
March 1st, 2008 23 Yes

CAS Number: 5630-53-5

Other Names:

MFCD00864178

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) 3.54 1.05 -6.68 1 2 0 37 312.453 0

Vendor Notes

Note Type Comments Provided By
MP 169 TCI

Activity (Go SEA)

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