UCSF

ZINC36146166

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 23rd, 2009 26 Yes

Popular Name: (5R,6R,8R)-6-(4-methylpiperazine-1-carbonyl)spiro[1,2,3,6,7,8-hexahydropyrrolizine-5,3'-indoline]-2' (5R,6R,8R)-6-(4-methylpiperazine…

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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) 2.02 2.76 -16.43 1 6 0 56 354.454 1 ↓
Mid Mid (pH 6-8) 2.02 5.1 -48.68 2 6 1 57 355.462 1 ↓
Mid Mid (pH 6-8) 2.02 4.9 -34.44 2 6 1 57 355.462 1 ↓
Lo Low (pH 4.5-6) 2.02 7.25 -84.25 3 6 2 58 356.47 1 ↓

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

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