UCSF

ZINC49564782

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 6th, 2010 20 No

Popular Name: (3S)-3-[[(1R,8R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl]amino]-1-[(1R)-1-methylpropyl]pyrrolidine- (3S)-3-[[(1R,8R)-2,3,5,6,7,8-hex…

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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) 0.64 6.87 -121.86 3 5 2 58 281.4 4 ↓
Hi High (pH 8-9.5) 0.64 6.08 -39.79 2 5 1 54 280.392 4 ↓
Hi High (pH 8-9.5) 0.64 3.58 -7.8 1 5 0 53 279.384 4 ↓

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

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