In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 20 | Yes |
Popular Name: (2R)-N-(3-amino-2-methyl-phenyl)-2-(butyl-ethyl-amino)propanamide (2R)-N-(3-amino-2-methyl-phenyl)…
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) | 3.13 | 6.92 | -38.06 | 4 | 4 | 1 | 60 | 278.42 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.13 | 4.73 | -11.42 | 3 | 4 | 0 | 58 | 277.412 | 7 | ↓ |