UCSF

ZINC25463995

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 29th, 2009 32 Yes

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

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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) 2.45 6.81 -56.48 0 9 -1 116 472.572 6 ↓
Mid Mid (pH 6-8) 2.45 6.73 -24.44 1 9 0 114 473.58 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.