UCSF

ZINC37236969

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 22nd, 2009 21 Yes

Popular Name: N-[(S)-cyclopropyl-(4-fluorophenyl)methyl]-1-propyl-piperidin-4-amine N-[(S)-cyclopropyl-(4-fluorophen…

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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) 4.01 9.9 -37.5 2 2 1 16 291.434 6 ↓
Lo Low (pH 4.5-6) 4.01 11.03 -113.23 3 2 2 21 292.442 6 ↓

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

No pre-computed analogs available. Try a structural similarity search.