In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 19 | Yes |
Popular Name: 1-[2-(aminomethyl)phenyl]-N-(cyclopropylmethyl)-N-ethyl-methanesulfonamide 1-[2-(aminomethyl)phenyl]-N-(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) | 1.70 | 4.59 | -54.26 | 3 | 4 | 1 | 65 | 283.417 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 4.23 | -10.07 | 2 | 4 | 0 | 63 | 282.409 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.