UCSF

ZINC57733783

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 24th, 2011 26 No

Popular Name: 2-[(6aR)-6,6a,7,8,9,11-hexahydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]-N-(5-methoxypentyl)-2-oxo-ace 2-[(6aR)-6,6a,7,8,9,11-hexahydro…

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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) 1.50 7.76 -36.48 2 6 1 63 360.478 7 ↓
Hi High (pH 8-9.5) 1.50 5.6 -7.49 1 6 0 62 359.47 7 ↓

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

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