UCSF

ZINC32547894

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2009 18 Yes

Popular Name: N-methyl-N-[(2S)-2-morpholinopropyl]cycloheptanamine N-methyl-N-[(2S)-2-morpholinopro…

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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) 2.96 6.8 -34.17 1 3 1 17 255.426 4 ↓
Lo Low (pH 4.5-6) 2.96 8.48 -115.69 2 3 2 18 256.434 4 ↓

Activity (Go SEA)

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