| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 17 | Yes |
Popular Name: (1S)-N-methyl-1-(3-methyl-2-thienyl)-N-(2-thienylmethyl)ethane-1,2-diamine (1S)-N-methyl-1-(3-methyl-2-thie…
| 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) | 2.30 | 4.81 | -43.64 | 3 | 2 | 1 | 31 | 267.443 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 3.99 | -3.45 | 2 | 2 | 0 | 29 | 266.435 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 6.12 | -28.24 | 3 | 2 | 1 | 30 | 267.443 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.30 | 6.72 | -116.87 | 4 | 2 | 2 | 32 | 268.451 | 5 | ↓ |
