UCSF

ZINC36869631

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 16th, 2009 21 No

Popular Name: N-[4-(aminomethyl)phenyl]-2-[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]acetamide N-[4-(aminomethyl)phenyl]-2-[[(3…

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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) 0.22 1.48 -114.33 5 6 2 95 313.423 5 ↓
Hi High (pH 8-9.5) 0.22 -0.73 -60.26 4 6 1 94 312.415 5 ↓

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

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