UCSF

ZINC35892760

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 14th, 2009 26 Yes

Popular Name: 4-(4-allylpiperazin-1-yl)-2-butyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine 4-(4-allylpiperazin-1-yl)-2-buty…

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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) 4.96 13.38 -42.84 1 4 1 33 371.574 6 ↓
Mid Mid (pH 6-8) 4.96 11.13 -6.05 0 4 0 32 370.566 6 ↓

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