In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 19th, 2009 | 20 | Yes |
Popular Name: 1-[3-(aminomethyl)phenyl]-N-(4-pyridylmethyl)methanesulfonamide 1-[3-(aminomethyl)phenyl]-N-(4-p…
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) | 0.34 | 1.49 | -55.79 | 4 | 5 | 1 | 87 | 292.384 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.34 | 1.94 | -96.3 | 5 | 5 | 2 | 88 | 293.392 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.