| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2010 | 19 | Yes |
Popular Name: (2S)-N1-cyclopentyl-N2-cyclopropyl-N2-(3-thienylmethyl)propane-1,2-diamine (2S)-N1-cyclopentyl-N2-cycloprop…
| 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) | 3.21 | 8.2 | -34.33 | 2 | 2 | 1 | 20 | 279.473 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.21 | 7.01 | -0.93 | 1 | 2 | 0 | 15 | 278.465 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.21 | 9.88 | -107.42 | 3 | 2 | 2 | 21 | 280.481 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
