UCSF

ZINC59416024

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
March 4th, 2011 28 No

Popular Name: 3-[[4,6-bis(1-piperidyl)-1,3,5-triazin-2-yl]sulfanyl]-6,6-dimethyl-1,4-dihydro-1,2,4-triazin-5-one 3-[[4,6-bis(1-piperidyl)-1,3,5-t…

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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) 4.15 11.01 -47.33 1 9 -1 105 403.536 4 ↓
Mid Mid (pH 6-8) 3.96 12.97 -9.29 2 9 0 99 404.544 4 ↓

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

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