UCSF

ZINC54443846

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 3rd, 2010 27 No

Popular Name: 1-[[4-(2-hydroxyphenyl)piperazin-1-yl]methyl]-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-thi 1-[[4-(2-hydroxyphenyl)piperazin…

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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) 2.27 9.5 -26.46 1 7 0 62 384.509 3 ↓
Mid Mid (pH 6-8) 2.27 11.25 -59.91 2 7 1 63 385.517 3 ↓

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

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