| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (1S)-N-methyl-N-(4-methylcyclohexyl)-1-(3-thienyl)ethane-1,2-diamine (1S)-N-methyl-N-(4-methylcyclohe…
| 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) | 1.99 | 4.49 | -42.71 | 3 | 2 | 1 | 31 | 253.435 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.99 | 6.46 | -128.5 | 4 | 2 | 2 | 32 | 254.443 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.99 | 6.08 | -31.29 | 3 | 2 | 1 | 30 | 253.435 | 4 | ↓ |
