UCSF

ZINC22716320

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 19th, 2008 36 Yes

Popular Name: (4-benzylpiperazin-1-yl)-[(4R)-4-(4-hydroxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazol-3 (4-benzylpiperazin-1-yl)-[(4R)-4…

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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) 4.22 11.8 -17.5 2 7 0 74 479.584 4 ↓
Mid Mid (pH 6-8) 4.22 14.07 -59.35 3 7 1 75 480.592 4 ↓
Lo Low (pH 4.5-6) 4.22 14.52 -100.64 4 7 2 76 481.6 4 ↓

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

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