UCSF

ZINC36134644

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 20 Yes

Popular Name: (2R,3aR,7aS)-N-[2-(cyclopropylamino)-2-oxo-ethyl]-N-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-c (2R,3aR,7aS)-N-[2-(cyclopropylam…

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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) 2.21 4.59 -38.15 3 5 1 66 280.392 4 ↓
Hi High (pH 8-9.5) 2.21 3.42 -13.23 2 5 0 61 279.384 4 ↓

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

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