UCSF

ZINC02083067

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 31 Yes

Popular Name: 2-[[keto(dimethyl)BLAHyl]methylthio]-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-4-one 2-[[keto(dimethyl)BLAHyl]methylt…

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Download: MOL2 SDF SMILES Flexibase

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) 5.26 9.24 -29.02 1 6 0 81 488.685 3 ↓
Hi High (pH 8-9.5) 5.72 7.86 -56.49 0 6 -1 84 487.677 3 ↓

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