UCSF

ZINC19735365

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 17 Yes

Popular Name: MFCD03545027 MFCD03545027

Find On: PubMed — Wikipedia — Google

CAS Number: 626222-53-5

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) -0.11 0.16 -101.53 0 6 -2 106 250.235 3 ↓
Ref Reference (pH 7) -0.11 0.17 -101.53 0 6 -2 106 250.235 3 ↓
Lo Low (pH 4.5-6) -0.29 2.7 -49.01 1 6 -1 99 251.243 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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