In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 17 | Yes |
Popular Name: N-[(1S)-1-cyclopropyl-1-(4-ethyl-5-methyl-thiazol-2-yl)ethyl]propan-1-amine N-[(1S)-1-cyclopropyl-1-(4-ethyl…
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) | 3.55 | 7.25 | -31.07 | 2 | 2 | 1 | 29 | 253.435 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.55 | 6.06 | -4.74 | 1 | 2 | 0 | 25 | 252.427 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.55 | 7.79 | -91.81 | 3 | 2 | 2 | 31 | 254.443 | 6 | ↓ |