UCSF

ZINC35734940

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 11th, 2009 19 Yes

Popular Name: (2S,3aS,7aS)-N-[(1S)-1-[(2S)-tetrahydrofuran-2-yl]ethyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-car (2S,3aS,7aS)-N-[(1S)-1-[(2S)-tet…

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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) 2.70 4.97 -37.04 3 4 1 55 267.393 3 ↓
Hi High (pH 8-9.5) 2.70 3.71 -7.9 2 4 0 50 266.385 3 ↓

Activity (Go SEA)

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