UCSF

ZINC62945555

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 19th, 2011 20 Yes

Popular Name: N-methyl-1-[(2S,5S)-5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)tetrahydrofuran-2-yl]methanamine N-methyl-1-[(2S,5S)-5-(1,3,4,5-t…

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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) 2.40 8.48 -91.5 3 3 2 30 276.424 4 ↓
Hi High (pH 8-9.5) 2.40 6.34 -34.42 2 3 1 29 275.416 4 ↓

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Rings

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

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