In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2006 | 14 | No |
Popular Name: (R)-4-Aminomethyl-thiazolidine-3-carboxylicacidtert-butylester (R)-4-Aminomethyl-thiazolidine-3…
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CAS Number: 391248-13-8
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) | 0.54 | 2.42 | -46.49 | 3 | 4 | 1 | 57 | 219.33 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.54 | 2.07 | -4.33 | 2 | 4 | 0 | 56 | 218.322 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.