UCSF

ZINC64540072

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 32 Yes

Popular Name: 4-[(3S)-1,1-dioxo-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazin-3-yl]-N-[2-(2H-indol-3-yl)ethyl]benzamide 4-[(3S)-1,1-dioxo-3,4-dihydro-2H…

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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) 3.25 5.19 -50.82 4 7 1 101 447.54 5 ↓
Hi High (pH 8-9.5) 3.25 4.53 -65.3 3 7 0 103 446.532 5 ↓

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

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