In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2011 | 18 | Yes |
Popular Name: 5-(aminomethyl)-N-[(1R)-1-cyclopentylethyl]pyridine-2-carboxamide 5-(aminomethyl)-N-[(1R)-1-cyclop…
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) | 1.26 | 3.3 | -55.87 | 4 | 4 | 1 | 70 | 248.35 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.26 | 2.9 | -7.06 | 3 | 4 | 0 | 68 | 247.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.