In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 15 | Yes |
Popular Name: [1-[(2R)-2-methylazepan-1-yl]cyclopentyl]methanamine [1-[(2R)-2-methylazepan-1-yl]cyc…
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) | 2.36 | 5.42 | -109.59 | 4 | 2 | 2 | 32 | 212.381 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.36 | 4.3 | -38.35 | 3 | 2 | 1 | 31 | 211.373 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 4.85 | -24.49 | 3 | 2 | 1 | 30 | 211.373 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.