UCSF

ZINC19520012

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2008 17 Yes

CAS Number: 303121-05-3

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 0.59 3.23 -48.05 1 5 -1 84 232.215 3

Vendor Notes

Note Type Comments Provided By
MP 270° (dec) Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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