In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 19 | Yes |
Popular Name: (1S,2R)-N1-benzyl-N1-methyl-1-phenyl-propane-1,2-diamine (1S,2R)-N1-benzyl-N1-methyl-1-ph…
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) | 2.53 | 8.82 | -118.94 | 4 | 2 | 2 | 32 | 256.393 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 5.93 | -43.12 | 3 | 2 | 1 | 31 | 255.385 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.53 | 8.6 | -34.15 | 3 | 2 | 1 | 30 | 255.385 | 5 | ↓ |