UCSF

ZINC66448239

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 25th, 2011 22 No

Popular Name: 3-[[(2R)-2-(3-bromophenyl)pyrrolidin-1-yl]methyl]-5-(dimethylamino)-1,3,4-thiadiazole-2-thione 3-[[(2R)-2-(3-bromophenyl)pyrrol…

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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) 3.40 9.59 -8.35 0 4 0 24 399.383 4 ↓
Lo Low (pH 4.5-6) 3.40 11.5 -34.2 1 4 1 26 400.391 4 ↓
Lo Low (pH 4.5-6) 3.40 9.74 -30.83 1 4 1 26 400.391 4 ↓

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

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