UCSF

ZINC02508269

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 Yes

CAS Number: 28819-05-8

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) 3.53 0.74 -7.05 1 5 0 64 237.255 6

Vendor Notes

Note Type Comments Provided By
MP 49-50o C Indofine

Activity (Go SEA)

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