UCSF

ZINC19364845

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 31st, 2008 12 Yes

Popular Name: (R)-N-Methyl-2-pyrrolidin-1-ylmethyl-pyrrolidine (R)-N-Methyl-2-pyrrolidin-1-ylme…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1217638-41-9 , 76411-80-8 , 909772-67-4

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) 1.17 4.69 -31.66 1 2 1 8 169.292 2 ↓
Mid Mid (pH 6-8) 1.17 7 -99.87 2 2 2 9 170.3 2 ↓
Mid Mid (pH 6-8) 1.17 4.53 -31.37 1 2 1 8 169.292 2 ↓

Activity (Go SEA)

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