UCSF

ZINC25464017

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 24 Yes

Popular Name: N-[3-(6,7-dihydro-5H-pyrrolo[1,2-d][1,2,4]triazol-3-yl)phenyl]-5-methyl-thiophene-2-sulfonamide N-[3-(6,7-dihydro-5H-pyrrolo[1,2…

Find On: PubMed — Wikipedia — Google

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) 2.90 7.36 -19.6 1 6 0 77 360.464 4 ↓
Mid Mid (pH 6-8) 2.90 7.44 -55.96 0 6 -1 79 359.456 4 ↓

Activity (Go SEA)

Rings

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