| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 17 | Yes |
Popular Name: (2S,3S)-N1-cyclopropyl-3-methyl-N1-(3-thienylmethyl)pentane-1,2-diamine (2S,3S)-N1-cyclopropyl-3-methyl-…
| 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) | 2.18 | 7.68 | -114.22 | 4 | 2 | 2 | 32 | 254.443 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 7.26 | -29.59 | 3 | 2 | 1 | 30 | 253.435 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 5.94 | -35.67 | 3 | 2 | 1 | 31 | 253.435 | 7 | ↓ |
