UCSF

ZINC32445495

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 30th, 2009 12 Yes

Popular Name: 3,3-dimethyl-1-pyrrolidin-1-ylbutan-2-amine 3,3-dimethyl-1-pyrrolidin-1-ylbu…

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CAS Number: 844882-19-5

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) 1.31 4.74 -114.49 4 2 2 32 172.316 3 ↓
Mid Mid (pH 6-8) 1.31 4.34 -28.27 3 2 1 30 171.308 3 ↓

Activity (Go SEA)

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