UCSF

ZINC67561275

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 11th, 2011 25 Yes

Popular Name: (2S,4R)-4-amino-1-[[(1S,4R)-7,7-dimethyl-2-oxo-norbornan-1-yl]methylsulfonyl]-N-ethyl-pyrrolidine-2- (2S,4R)-4-amino-1-[[(1S,4R)-7,7-…

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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) -0.52 3.05 -74.97 4 7 1 111 372.511 5 ↓
Mid Mid (pH 6-8) -0.52 2.37 -26.06 3 7 0 110 371.503 5 ↓

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

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