UCSF

ZINC24569917

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2009 31 Yes

Popular Name: N-(3-cyano-1-phenyl-4,5,6,7-tetrahydroindol-2-yl)-2-[(5-hydroxy-4-propyl-1,2,4-triazol-3-yl)sulfanyl N-(3-cyano-1-phenyl-4,5,6,7-tetr…

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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) 2.94 11.02 -19.03 2 8 0 109 436.541 7 ↓
Hi High (pH 8-9.5) 3.40 10.23 -53.2 1 8 -1 112 435.533 7 ↓

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

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