In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2010 | 19 | Yes |
Popular Name: (1R)-N-methyl-N-[(1R,3S)-3-methylcyclohexyl]-1-(m-tolyl)ethane-1,2-diamine (1R)-N-methyl-N-[(1R,3S)-3-methy…
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) | 3.07 | 8.26 | -128.5 | 4 | 2 | 2 | 32 | 262.441 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.07 | 7.82 | -28.53 | 3 | 2 | 1 | 30 | 261.433 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 5.9 | -43.54 | 3 | 2 | 1 | 31 | 261.433 | 4 | ↓ |