UCSF

ZINC22775034

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 29 No

Popular Name: 1-[[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin 1-[[4-[(4-isopropylphenyl)methyl…

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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) 3.38 13.86 -63.73 1 6 1 43 411.599 5 ↓
Mid Mid (pH 6-8) 3.38 13.82 -59.9 1 6 1 43 411.599 5 ↓
Mid Mid (pH 6-8) 3.38 11.49 -28.35 0 6 0 42 410.591 5 ↓

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

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