UCSF

ZINC13123632

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 29 Yes

Popular Name: (7S)-7-(2,3-dimethoxyphenyl)-5-methyl-N-(3-pyridyl)-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxam (7S)-7-(2,3-dimethoxyphenyl)-5-m…

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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) 1.43 7.03 -11.52 2 10 0 116 393.407 5 ↓
Hi High (pH 8-9.5) 1.62 6.19 -48.48 1 10 -1 122 392.399 5 ↓
Hi High (pH 8-9.5) 1.80 7.08 -53.52 2 10 0 127 393.407 5 ↓
Lo Low (pH 4.5-6) 1.61 7.3 -36.33 3 10 1 121 394.415 5 ↓

Activity (Go SEA)

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