UCSF

ZINC65527616

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 21 Yes

Popular Name: (3aR,4S)-4-[(2R)-5-methoxy-3-methyl-2H-indol-2-yl]-4,5,6,7-tetrahydro-3aH-imidazo[4,5-c]pyridine (3aR,4S)-4-[(2R)-5-methoxy-3-met…

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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) 2.13 4.66 -89.43 4 5 2 65 284.363 2 ↓
Mid Mid (pH 6-8) 2.13 4.19 -25.07 3 5 1 64 283.355 2 ↓

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

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