UCSF

ZINC08714283

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2007 19 Yes

Popular Name: 1-Methylamino-3-(1,2,3,4-tetrahydro-carbazol-9-yl)-propan-2-ol 1-Methylamino-3-(1,2,3,4-tetrahy…

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CAS Number: 801228-20-6

Download: MOL2 SDF SMILES Flexibase

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) 2.54 6.4 -48.15 3 3 1 42 259.373 4 ↓
Hi High (pH 8-9.5) 2.54 4.88 -7.87 2 3 0 37 258.365 4 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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