UCSF

ZINC65519737

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2011 24 Yes

Popular Name: 4-[[4-(6-ethyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-4-yl)piperazin-1-yl]methyl]thiazole 4-[[4-(6-ethyl-7,8-dihydro-5H-py…

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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) 1.30 8.23 -102.64 2 6 2 51 346.504 4 ↓
Mid Mid (pH 6-8) 1.30 7.79 -44.14 1 6 1 50 345.496 4 ↓
Mid Mid (pH 6-8) 1.30 10.03 -97.43 2 6 2 51 346.504 4 ↓

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

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