UCSF

ZINC35017613

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 2nd, 2009 21 Yes

Popular Name: N-[(2-bromo-4,5-dimethoxy-phenyl)methyl]-3-(cyclopropylmethoxy)propan-1-amine N-[(2-bromo-4,5-dimethoxy-phenyl…

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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) 3.01 7.42 -43.17 2 4 1 44 359.284 10 ↓
Hi High (pH 8-9.5) 3.01 6.06 -6.71 1 4 0 40 358.276 10 ↓

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

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