UCSF

ZINC62986987

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2011 14 Yes

Popular Name: N-isopropyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]thiazol-2-amine N-isopropyl-5,6,7,8-tetrahydro-4…

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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) 3.27 6.43 -5.16 1 2 0 25 210.346 2 ↓
Mid Mid (pH 6-8) 3.27 6.76 -22.06 2 2 1 26 211.354 2 ↓

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

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