UCSF

ZINC18272284

Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2008 11 Yes

CAS Number: 37526-53-7

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) -0.14 -0.94 -6.03 1 6 0 77 151.129 1

Vendor Notes

Note Type Comments Provided By
mechanism Metabolically activated alkylator ZereneX Building Blocks
biological_use Cytostatic IBScreen Bioactives
mechanism Metabolically activated alkylator IBScreen Bioactives
biological_source Prod. by Pseudomonas fluorescens ZereneX Building Blocks

Activity (Go SEA)

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