UCSF

ZINC21530156

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 28 No

Popular Name: (8aS)-7-[[4-(4-ethylpiperazine-1-carbonyl)phenyl]methyl]-1,3,6,8a-tetrahydrothiazolo[4,3-c]pyrazine- (8aS)-7-[[4-(4-ethylpiperazine-1…

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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) -0.13 8.16 -51.98 1 7 1 65 403.528 4 ↓
Mid Mid (pH 6-8) -0.13 5.89 -17.03 0 7 0 64 402.52 4 ↓

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

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