In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 25th, 2009 | 19 | Yes |
Popular Name: (1S,2R)-N2-benzyl-N2-methyl-1-phenyl-propane-1,2-diamine (1S,2R)-N2-benzyl-N2-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) | 1.19 | 6.33 | -46.15 | 3 | 2 | 1 | 31 | 255.385 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 6.04 | -2.64 | 2 | 2 | 0 | 29 | 254.377 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.19 | 8.38 | -118.64 | 4 | 2 | 2 | 32 | 256.393 | 5 | ↓ |