UCSF

ZINC04935100

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 11th, 2006 18 Yes

Popular Name: MFCD07395215 MFCD07395215

Find On: PubMed — Wikipedia — Google

CAS Number: 878714-35-3

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) 1.83 6.65 -52.82 1 4 -1 65 241.27 4 ↓
Lo Low (pH 4.5-6) 1.83 7.11 -76.39 2 4 0 66 242.278 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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