UCSF

ZINC35017609

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 20 No

Popular Name: 3-(cyclopropylmethoxy)-N-[(4-methyl-3-nitro-phenyl)methyl]propan-1-amine 3-(cyclopropylmethoxy)-N-[(4-met…

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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) 2.96 8.98 -54.57 2 5 1 72 279.36 9 ↓
Hi High (pH 8-9.5) 2.96 7.62 -8.85 1 5 0 67 278.352 9 ↓

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

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