UCSF

ZINC37097203

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 20th, 2009 21 Yes

Popular Name: (1S)-N'-cyclopropyl-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N'-propyl-ethane-1,2-diamine (1S)-N'-cyclopropyl-1-(3,4-dihyd…

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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) 0.48 7.2 -38.7 3 4 1 49 291.415 6 ↓
Mid Mid (pH 6-8) 0.48 7.54 -134.25 4 4 2 51 292.423 6 ↓

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

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