UCSF

ZINC22775122

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 20th, 2008 27 No

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

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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) 2.54 12.43 -66.49 1 6 1 43 403.963 4 ↓
Mid Mid (pH 6-8) 2.54 12.39 -64.92 1 6 1 43 403.963 4 ↓
Mid Mid (pH 6-8) 2.54 10.06 -28.93 0 6 0 42 402.955 4 ↓

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

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