UCSF

ZINC37816794

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 1st, 2009 19 Yes

Popular Name: (1-aminocyclohexyl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone (1-aminocyclohexyl)-[4-(cyclopro…

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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) 1.81 3.63 -47.85 3 4 1 51 266.409 3 ↓
Hi High (pH 8-9.5) 1.81 3.76 -6.27 2 4 0 50 265.401 3 ↓
Mid Mid (pH 6-8) 1.81 5.83 -114.87 4 4 2 52 267.417 3 ↓
Mid Mid (pH 6-8) 1.81 6.08 -43.83 3 4 1 51 266.409 3 ↓

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Rings

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