UCSF

ZINC53388317

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 21st, 2010 14 No

Popular Name: N'-cyclopropyl-N-[(3S)-1,1-dioxothiolan-3-yl]ethane-1,2-diamine N'-cyclopropyl-N-[(3S)-1,1-dioxo…

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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) -0.23 -0.25 -49.7 3 4 1 63 219.33 5 ↓
Hi High (pH 8-9.5) -0.23 -1.54 -11.12 2 4 0 58 218.322 5 ↓
Mid Mid (pH 6-8) -0.23 0.93 -141.35 4 4 2 67 220.338 5 ↓

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

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