UCSF

ZINC44722831

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 21st, 2010 15 Yes

Popular Name: 2-[[(3R)-1-cyclopropylpyrrolidin-3-yl]amino]-N-ethyl-acetamide 2-[[(3R)-1-cyclopropylpyrrolidin…

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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) 0.60 2.56 -36.88 3 4 1 46 212.317 5 ↓
Hi High (pH 8-9.5) 0.60 0.23 -7.22 2 4 0 44 211.309 5 ↓
Lo Low (pH 4.5-6) 0.60 3.77 -109.37 4 4 2 50 213.325 5 ↓

Activity (Go SEA)

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