In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 19 | Yes |
Popular Name: (2S)-4-(2-methoxy-4-methyl-phenoxy)-N,N,2-trimethyl-butane-1,2-diamine (2S)-4-(2-methoxy-4-methyl-pheno…
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) | 1.57 | 3.67 | -45.66 | 3 | 4 | 1 | 49 | 267.393 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.57 | 5.18 | -35.55 | 3 | 4 | 1 | 49 | 267.393 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.57 | 5.71 | -124.39 | 4 | 4 | 2 | 51 | 268.401 | 7 | ↓ |