UCSF

ZINC07365308

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 26th, 2006 15 Yes

Popular Name: N-(2-pyridylmethyl)cycloheptanamine N-(2-pyridylmethyl)cycloheptanamine

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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) 2.74 6.32 -35.95 2 2 1 29 205.325 3 ↓
Lo Low (pH 4.5-6) 2.74 6.6 -106.92 3 2 2 31 206.333 3 ↓

Activity (Go SEA)

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