| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2010 | 21 | No |
Popular Name: (2S)-N1,N1,4-trimethyl-N2-[(5S)-5-phenyl-4,5-dihydrothiazol-2-yl]pentane-1,2-diamine (2S)-N1,N1,4-trimethyl-N2-[(5S)-…
| 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) | 3.65 | 10.28 | -95.43 | 3 | 3 | 2 | 30 | 307.507 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.65 | 7.65 | -26.44 | 2 | 3 | 1 | 29 | 306.499 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.65 | 7.69 | -26.4 | 2 | 3 | 1 | 29 | 306.499 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
