UCSF

ZINC63270595

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 27th, 2011 32 Yes

Popular Name: (1R,9aR)-2-[2-(4-methylpiperazin-1-yl)acetyl]spiro[4,9a-dihydro-3H-pyrido[3,4-b]indole-1,3'-indoline (1R,9aR)-2-[2-(4-methylpiperazin…

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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) 1.89 8.26 -80.58 3 7 2 71 431.54 2 ↓
Hi High (pH 8-9.5) 1.89 5.87 -39.89 2 7 1 70 430.532 2 ↓

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

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