UCSF

ZINC34274393

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 21st, 2009 18 Yes

Popular Name: (1S,2R)-N-methyl-2-(4-methylpiperazin-1-yl)indan-1-amine (1S,2R)-N-methyl-2-(4-methylpipe…

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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) 1.58 7.04 -92.33 3 3 2 24 247.386 2 ↓
Mid Mid (pH 6-8) 1.58 4.84 -30.1 2 3 1 20 246.378 2 ↓
Mid Mid (pH 6-8) 1.58 5.79 -113.24 3 3 2 24 247.386 2 ↓
Mid Mid (pH 6-8) 1.58 4.67 -36.45 2 3 1 23 246.378 2 ↓

Activity (Go SEA)

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