UCSF

ZINC12153277

Substance Information

In ZINC since Heavy atoms Benign functionality
April 2nd, 2008 23 No

CAS Number: 7240-90-6

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) 1.21 -10.78 -11.94 5 7 0 115 408.632 3

Vendor Notes

Note Type Comments Provided By
MP 236-238° Matrix Scientific
Purity 98% Matrix Scientific
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Store in Freezer Matrix Scientific

Activity (Go SEA)

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