UCSF

ZINC63013530

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 22nd, 2011 21 Yes

Popular Name: N-[(2R)-2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-2-methyl-butyl]cyclopropanamine N-[(2R)-2-(3,5-dihydro-2H-1,4-be…

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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) 3.25 7.92 -39.66 2 3 1 29 289.443 6 ↓
Lo Low (pH 4.5-6) 3.25 9.38 -101.7 3 3 2 30 290.451 6 ↓

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

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